N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-5-keto-1-(3-methoxyphenyl)pyrrolidine-3-carboxamide Formula: C26H33N3O7S MolecularWeight: 531.62112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCCCS(=O)(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCCCS(=O)(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C26H33N3O7S/c1-34-22-7-4-6-21(15-22)29-17-20(14-25(29)30)26(31)27-9-5-11-37(32,33)28-10-8-18-12-23(35-2)24(36-3)13-19(18)16-28/h4,6-7,12-13,15,20H,5,8-11,14,16-17H2,1-3H3,(H,27,31)