N3-butan-2-yl-1-cyclopentyl-4-oxidanylidene-N5-(thiophen-3-ylmethyl)pyridine-3,5-dicarboxamide

Systemtic Name: N3-butan-2-yl-1-cyclopentyl-4-oxidanylidene-N5-(thiophen-3-ylmethyl)pyridine-3,5-dicarboxamide Openeye Name: 1-cyclopentyl-4-oxo-N3-sec-butyl-N5-(3-thienylmethyl)pyridine-3,5-dicarboxamide CAS Name: N3-butan-2-yl-1-cyclopentyl-4-oxo-N5-(3-thiophenylmethyl)pyridine-3,5-dicarboxamide IUPAC Name: 3-N-butan-2-yl-1-cyclopentyl-4-oxo-5-N-(thiophen-3-ylmethyl)pyridine-3,5-dicarboxamide Traditional Name: 1-cyclopentyl-4-keto-N-sec-butyl-N'-(3-thenyl)dinicotinamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)NCC2=CSC=C2)C3CCCC3

Isomeric SMILES

CCC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)NCC2=CSC=C2)C3CCCC3

InChI

InChI=1S/C21H27N3O3S/c1-3-14(2)23-21(27)18-12-24(16-6-4-5-7-16)11-17(19(18)25)20(26)22-10-15-8-9-28-13-15/h8-9,11-14,16H,3-7,10H2,1-2H3,(H,22,26)(H,23,27)