N-[3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonylphenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonylphenyl]pyridine-3-carboxamide Openeye Name: N-[3-[4-(2-thienylmethyl)piperazine-1-carbonyl]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[4-(thiophen-2-ylmethyl)piperazine-1-carbonyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[4-(2-thenyl)piperazine-1-carbonyl]phenyl]nicotinamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H22N4O2S/c27-21(18-5-2-8-23-15-18)24-19-6-1-4-17(14-19)22(28)26-11-9-25(10-12-26)16-20-7-3-13-29-20/h1-8,13-15H,9-12,16H2,(H,24,27)