N-[1-[2-[4-(6-methylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrazol-4-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[1-[2-[4-(6-methylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrazol-4-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[1-[2-[4-(6-methyl-2-pyridyl)piperazin-1-yl]-2-oxo-ethyl]pyrazol-4-yl]-2-phenylsulfanyl-acetamide CAS Name: N-[1-[2-[4-(6-methyl-2-pyridinyl)-1-piperazinyl]-2-oxoethyl]-4-pyrazolyl]-2-(phenylthio)acetamide IUPAC Name: N-[1-[2-[4-(6-methylpyridin-2-yl)piperazin-1-yl]-2-oxoethyl]pyrazol-4-yl]-2-phenylsulfanylacetamide Traditional Name: N-[1-[2-keto-2-[4-(6-methyl-2-pyridyl)piperazino]ethyl]pyrazol-4-yl]-2-(phenylthio)acetamide Formula: C23H26N6O2S MolecularWeight: 450.55654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2CCN(CC2)C(=O)CN3C=C(C=N3)NC(=O)CSC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC=C1)N2CCN(CC2)C(=O)CN3C=C(C=N3)NC(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C23H26N6O2S/c1-18-6-5-9-21(25-18)27-10-12-28(13-11-27)23(31)16-29-15-19(14-24-29)26-22(30)17-32-20-7-3-2-4-8-20/h2-9,14-15H,10-13,16-17H2,1H3,(H,26,30)