N-[3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[3-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[3-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[3-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H23ClN6O2S MolecularWeight: 470.97502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H23ClN6O2S/c1-27-15-24-26-22(27)32-14-20(30)25-18-6-2-4-16(12-18)21(31)29-10-8-28(9-11-29)19-7-3-5-17(23)13-19/h2-7,12-13,15H,8-11,14H2,1H3,(H,25,30)