2-cyclopropyl-3-(3-methoxyphenyl)-1-oxidanylidene-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxidanylidene-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-N-[2-(2-thienyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-1-keto-3-(3-methoxyphenyl)-N-[2-(2-thienyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCCC5=CC=CS5

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCCC5=CC=CS5

InChI

InChI=1S/C26H26N2O3S/c1-31-19-7-4-6-17(16-19)24-23(25(29)27-14-13-20-8-5-15-32-20)21-9-2-3-10-22(21)26(30)28(24)18-11-12-18/h2-10,15-16,18,23-24H,11-14H2,1H3,(H,27,29)