1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide Openeye Name: 5-oxo-1-(p-tolyl)-2-(2-thienyl)-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide CAS Name: 1-(4-methylphenyl)-5-oxo-2-thiophen-2-yl-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-methylphenyl)-5-oxo-2-thiophen-2-yl-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide Traditional Name: 5-keto-1-(p-tolyl)-2-(2-thienyl)-N-[2-(1,2,4-triazol-1-ylmethyl)benzyl]pyrrolidine-3-carboxamide Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)NCC3=CC=CC=C3CN4C=NC=N4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)NCC3=CC=CC=C3CN4C=NC=N4)C5=CC=CS5

InChI

InChI=1S/C26H25N5O2S/c1-18-8-10-21(11-9-18)31-24(32)13-22(25(31)23-7-4-12-34-23)26(33)28-14-19-5-2-3-6-20(19)15-30-17-27-16-29-30/h2-12,16-17,22,25H,13-15H2,1H3,(H,28,33)