4-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxamide

Systemtic Name: 4-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxamide Openeye Name: 4-(p-tolyl)-N-(2-pyridylmethyl)-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxamide CAS Name: 4-(4-methylphenyl)-1-[oxo(thiophen-2-yl)methyl]-N-(2-pyridinylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: 4-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxamide Traditional Name: 4-(p-tolyl)-N-(2-pyridylmethyl)-1-(2-thenoyl)pyrrolidine-3-carboxamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2C(=O)NCC3=CC=CC=N3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC2C(=O)NCC3=CC=CC=N3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H23N3O2S/c1-16-7-9-17(10-8-16)19-14-26(23(28)21-6-4-12-29-21)15-20(19)22(27)25-13-18-5-2-3-11-24-18/h2-12,19-20H,13-15H2,1H3,(H,25,27)