6-(4,5-dimethoxy-2-morpholin-4-ylsulfonyl-phenyl)-1-[2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]-5,6-dihydro-2H-azepin-7-one

Systemtic Name: 6-(4,5-dimethoxy-2-morpholin-4-ylsulfonyl-phenyl)-1-[2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]-5,6-dihydro-2H-azepin-7-one Openeye Name: 6-(4,5-dimethoxy-2-morpholinosulfonyl-phenyl)-1-[2-(3-hydroxypyrrolidin-1-yl)-1-phenyl-ethyl]-5,6-dihydro-2H-azepin-7-one CAS Name: 6-[4,5-dimethoxy-2-(4-morpholinylsulfonyl)phenyl]-1-[2-(3-hydroxy-1-pyrrolidinyl)-1-phenylethyl]-5,6-dihydro-2H-azepin-7-one IUPAC Name: 6-(4,5-dimethoxy-2-morpholin-4-ylsulfonylphenyl)-1-[2-(3-hydroxypyrrolidin-1-yl)-1-phenylethyl]-5,6-dihydro-2H-azepin-7-one Traditional Name: 6-(4,5-dimethoxy-2-morpholinosulfonyl-phenyl)-1-[2-(3-hydroxypyrrolidino)-1-phenyl-ethyl]-5,6-dihydro-2H-azepin-7-one Formula: C30H39N3O7S MolecularWeight: 585.71156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2CC=CCN(C2=O)C(CN3CCC(C3)O)C4=CC=CC=C4)S(=O)(=O)N5CCOCC5)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2CC=CCN(C2=O)C(CN3CCC(C3)O)C4=CC=CC=C4)S(=O)(=O)N5CCOCC5)OC

InChI

InChI=1S/C30H39N3O7S/c1-38-27-18-25(29(19-28(27)39-2)41(36,37)32-14-16-40-17-15-32)24-10-6-7-12-33(30(24)35)26(22-8-4-3-5-9-22)21-31-13-11-23(34)20-31/h3-9,18-19,23-24,26,34H,10-17,20-21H2,1-2H3