2-cyclopentyl-N-(4-methylphenyl)-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclopentyl-N-(4-methylphenyl)-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopentyl-1-oxo-N-(p-tolyl)-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopentyl-N-(4-methylphenyl)-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopentyl-N-(4-methylphenyl)-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopentyl-1-keto-N-(p-tolyl)-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCC4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCC4)C5=CC=CS5

InChI

InChI=1S/C26H26N2O2S/c1-17-12-14-18(15-13-17)27-25(29)23-20-9-4-5-10-21(20)26(30)28(19-7-2-3-8-19)24(23)22-11-6-16-31-22/h4-6,9-16,19,23-24H,2-3,7-8H2,1H3,(H,27,29)