Products 3033586-04-5

CAS 3033586-04-5 is the registry number for SMD-1087. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

(2S,4R)-1-[(2S)-2-[[4-[[4-(4'-chloro-5'-oxospiro[cyclohexane-1,7'-indolo[1,2-a]quinazoline]-10'-yl)piperidin-1-yl]methyl]cyclohexanecarbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide (CAS 3033586-04-5) is a chemical compound with the molecular formula C56H68ClN7O5S and a molecular weight of 986.7 g/mol. IUPAC name: (2S,4R)-1-[(2S)-2-[[4-[[4-(4'-chloro-5'-oxospiro[cyclohexane-1,7'-indolo[1,2-a]quinazoline]-10'-yl)piperidin-1-yl]methyl]cyclohexanecarbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide. InChIKey: VHTCCGAJVGXIRY-UOJGIMESSA-N.

Identity
Molecular formulaC56H68ClN7O5S
Molecular weight986.7 g/mol
IUPAC name(2S,4R)-1-[(2S)-2-[[4-[[4-(4'-chloro-5'-oxospiro[cyclohexane-1,7'-indolo[1,2-a]quinazoline]-10'-yl)piperidin-1-yl]methyl]cyclohexanecarbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
InChIKeyVHTCCGAJVGXIRY-UOJGIMESSA-N
SMILESCC1=C(SC=N1)C2=CC=C(C=C2)[C@H](C)NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)C4CCC(CC4)CN5CCC(CC5)C6=CC7=C(C=C6)C8(CCCCC8)C9=NC(=O)C1=C(N79)C=CC=C1Cl)O

Computed by PubChem (NCBI)

Synonyms: orb2944974