Products 3077480-59-9

CAS 3077480-59-9 is the registry number for Z52, 95.80%. Offered by: MedChemExpress. Available pack sizes: 1 mg, 100 μg, 500 μg.

Structural formula: {0} (CAS {1})

N-[20-[5-[3-[4-(aminomethyl)-4-cyanopiperidin-1-yl]prop-1-ynyl]-2-(1-methoxyethyl)-3-pyridinyl]-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetrazapentacyclo[17.5.2.12,5.19,13.022,26]octacosa-1(25),2,5(28),19,22(26),23-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide (CAS 3077480-59-9) is a chemical compound with the molecular formula C50H61N9O6S and a molecular weight of 916.1 g/mol. IUPAC name: N-[20-[5-[3-[4-(aminomethyl)-4-cyanopiperidin-1-yl]prop-1-ynyl]-2-(1-methoxyethyl)-3-pyridinyl]-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetrazapentacyclo[17.5.2.12,5.19,13.022,26]octacosa-1(25),2,5(28),19,22(26),23-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide. InChIKey: VCFXNCUOMGCYNO-UHFFFAOYSA-N.

Identity
Molecular formulaC50H61N9O6S
Molecular weight916.1 g/mol
IUPAC nameN-[20-[5-[3-[4-(aminomethyl)-4-cyanopiperidin-1-yl]prop-1-ynyl]-2-(1-methoxyethyl)-3-pyridinyl]-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetrazapentacyclo[17.5.2.12,5.19,13.022,26]octacosa-1(25),2,5(28),19,22(26),23-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide
InChIKeyVCFXNCUOMGCYNO-UHFFFAOYSA-N
SMILESCCN1C2=C3C=C(C=C2)C4=CSC(=N4)CC(C(=O)N5CCCC(N5)C(=O)OCC(CC3=C1C6=C(N=CC(=C6)C#CCN7CCC(CC7)(CN)C#N)C(C)OC)(C)C)NC(=O)C8C9C8COC9

Computed by PubChem (NCBI)

Synonyms: orb3173544