N-cyclopentyl-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxidanylidene-N-(thiophen-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-cyclopentyl-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxidanylidene-N-(thiophen-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-cyclopentyl-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-N-(2-thienylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-cyclopentyl-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-N-(thiophen-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-cyclopentyl-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-N-(thiophen-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-cyclopentyl-3-(1H-indol-3-yl)-1-keto-2-(2-methoxyethyl)-N-(2-thenyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C31H33N3O3S MolecularWeight: 527.67702

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N(CC3=CC=CS3)C4CCCC4)C5=CNC6=CC=CC=C65

Isomeric SMILES

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N(CC3=CC=CS3)C4CCCC4)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C31H33N3O3S/c1-37-17-16-33-29(26-19-32-27-15-7-6-12-23(26)27)28(24-13-4-5-14-25(24)30(33)35)31(36)34(21-9-2-3-10-21)20-22-11-8-18-38-22/h4-8,11-15,18-19,21,28-29,32H,2-3,9-10,16-17,20H2,1H3