N-[4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[4-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide Openeye Name: N-[4-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide CAS Name: N-[4-[2-[3-(methylthio)anilino]-2-oxoethyl]-2-thiazolyl]-4-(2-pyridinyl)-1-piperazinecarboxamide IUPAC Name: N-[4-[2-(3-methylsulfanylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]-4-pyridin-2-ylpiperazine-1-carboxamide Traditional Name: N-[4-[2-keto-2-[3-(methylthio)anilino]ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide Formula: C22H24N6O2S2 MolecularWeight: 468.59496

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H24N6O2S2/c1-31-18-6-4-5-16(13-18)24-20(29)14-17-15-32-21(25-17)26-22(30)28-11-9-27(10-12-28)19-7-2-3-8-23-19/h2-8,13,15H,9-12,14H2,1H3,(H,24,29)(H,25,26,30)