N-[6-[4-(4-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[6-[4-(4-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Openeye Name: N-[6-[4-(4-methylbenzoyl)piperazin-1-yl]-3-pyridyl]thiophene-2-carboxamide CAS Name: N-[6-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: N-[6-[4-(4-methylbenzoyl)piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Traditional Name: N-[6-(4-p-toluoylpiperazino)-3-pyridyl]thiophene-2-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H22N4O2S/c1-16-4-6-17(7-5-16)22(28)26-12-10-25(11-13-26)20-9-8-18(15-23-20)24-21(27)19-3-2-14-29-19/h2-9,14-15H,10-13H2,1H3,(H,24,27)