4-methyl-3-(2-methylpropylsulfanyl)-5-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-(2-methylpropylsulfanyl)-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-5-isobutylsulfanyl-4-methyl-1,2,4-triazole CAS Name: 4-methyl-3-(2-methylpropylthio)-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazole Traditional Name: 3-benzyl-5-(isobutylthio)-4-methyl-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CSC1=NN=C(N1C)CC2=CC=CC=C2

InChI

InChI=1S/C14H19N3S/c1-11(2)10-18-14-16-15-13(17(14)3)9-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3