4-[4-(3-methylphenyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[4-(3-methylphenyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(m-tolyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(3-methylphenyl)-5-(3-phenylpropylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(3-methylphenyl)-5-(3-phenylpropylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-(m-tolyl)-5-(3-phenylpropylthio)-1,2,4-triazol-3-yl]pyridine Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCCCC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCCCC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C23H22N4S/c1-18-7-5-11-21(17-18)27-22(20-12-14-24-15-13-20)25-26-23(27)28-16-6-10-19-8-3-2-4-9-19/h2-5,7-9,11-15,17H,6,10,16H2,1H3