Products 1298053-61-8

CAS 1298053-61-8 is the registry number for Deldeprevir Na. Offered by: TargetMol. Available pack sizes: 25mg, 50mg, 100mg.

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

Sodium cyclopropylsulfonyl-[(1S,4R,6S,7Z,14R,18R)-14-[2-(3,3-difluoropiperidin-1-yl)-2-oxoethyl]-18-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carbonyl]azanide (CAS 1298053-61-8) is a chemical compound with the molecular formula C45H55F2N6NaO8S2 and a molecular weight of 933.1 g/mol. IUPAC name: sodium cyclopropylsulfonyl-[(1S,4R,6S,7Z,14R,18R)-14-[2-(3,3-difluoropiperidin-1-yl)-2-oxoethyl]-18-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carbonyl]azanide. InChIKey: KLBYIWFUEHNOSA-ACPQSSBHSA-M.

Identity
Molecular formulaC45H55F2N6NaO8S2
Molecular weight933.1 g/mol
IUPAC namesodium cyclopropylsulfonyl-[(1S,4R,6S,7Z,14R,18R)-14-[2-(3,3-difluoropiperidin-1-yl)-2-oxoethyl]-18-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carbonyl]azanide
InChIKeyKLBYIWFUEHNOSA-ACPQSSBHSA-M
SMILESCC1=C(C=CC2=C1N=C(C=C2O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)CC(=O)N6CCCC(C6)(F)F)C(=O)[N-]S(=O)(=O)C7CC7)C8=NC(=CS8)C(C)C)OC.[Na+]

Computed by PubChem (NCBI)