N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-5-keto-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H29N3O2S/c1-19-6-8-24(9-7-19)30-17-23(14-26(30)31)27(32)28-15-25(22-11-13-33-18-22)29-12-10-20-4-2-3-5-21(20)16-29/h2-9,11,13,18,23,25H,10,12,14-17H2,1H3,(H,28,32)