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

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-5-keto-1-(3-methoxyphenyl)pyrrolidine-3-carboxamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H29N3O3S/c1-33-24-8-4-7-23(14-24)30-17-22(13-26(30)31)27(32)28-15-25(21-10-12-34-18-21)29-11-9-19-5-2-3-6-20(19)16-29/h2-8,10,12,14,18,22,25H,9,11,13,15-17H2,1H3,(H,28,32)