3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one

Systemtic Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one Openeye Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-(4-phenyl-1-piperidyl)propan-1-one CAS Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenyl-1-piperidinyl)-1-propanone IUPAC Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one Traditional Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-(4-phenylpiperidino)propan-1-one Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-17-6-5-9-20(16-17)22-24-25-23(29)27(22)15-12-21(28)26-13-10-19(11-14-26)18-7-3-2-4-8-18/h2-9,16,19H,10-15H2,1H3,(H,25,29)