1-(3,4-dimethylphenyl)-5-oxidanylidene-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)-5-oxidanylidene-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)pyrrolidine-3-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)-5-oxo-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyrrolidine-3-carboxamide CAS Name: 1-(3,4-dimethylphenyl)-5-oxo-N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)-5-oxo-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyrrolidine-3-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)-5-keto-N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyrrolidine-3-carboxamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(CCN(C4)C(=O)C5=CC=CS5)C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(CCN(C4)C(=O)C5=CC=CS5)C=C3)C

InChI

InChI=1S/C27H27N3O3S/c1-17-5-8-23(12-18(17)2)30-16-21(14-25(30)31)26(32)28-22-7-6-19-9-10-29(15-20(19)13-22)27(33)24-4-3-11-34-24/h3-8,11-13,21H,9-10,14-16H2,1-2H3,(H,28,32)