3-(4-chlorophenyl)-4-methyl-5-(1-phenylethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-4-methyl-5-(1-phenylethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-4-methyl-5-(1-phenylethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-4-methyl-5-(1-phenylethylthio)-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-4-methyl-5-(1-phenylethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-4-methyl-5-(1-phenylethylthio)-1,2,4-triazole Formula: C17H16ClN3S MolecularWeight: 329.84704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3S/c1-12(13-6-4-3-5-7-13)22-17-20-19-16(21(17)2)14-8-10-15(18)11-9-14/h3-12H,1-2H3