[4-(4-methylphenyl)sulfanylpiperidin-1-yl]-(1-phenethyl-1,2,3-triazol-4-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfanylpiperidin-1-yl]-(1-phenethyl-1,2,3-triazol-4-yl)methanone Openeye Name: (1-phenethyltriazol-4-yl)-[4-(p-tolylsulfanyl)-1-piperidyl]methanone CAS Name: [4-[(4-methylphenyl)thio]-1-piperidinyl]-(1-phenethyl-4-triazolyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfanylpiperidin-1-yl]-(1-phenethyltriazol-4-yl)methanone Traditional Name: (1-phenethyltriazol-4-yl)-[4-(p-tolylthio)piperidino]methanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CCN(CC2)C(=O)C3=CN(N=N3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2CCN(CC2)C(=O)C3=CN(N=N3)CCC4=CC=CC=C4

InChI

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