[4-(4-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methanamine

Systemtic Name: [4-(4-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methanamine Openeye Name: [5-benzylsulfanyl-4-(p-tolyl)-1,2,4-triazol-3-yl]methanamine CAS Name: [4-(4-methylphenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methanamine IUPAC Name: [5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methanamine Traditional Name: [5-(benzylthio)-4-(p-tolyl)-1,2,4-triazol-3-yl]methylamine Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)CN

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)CN

InChI

InChI=1S/C17H18N4S/c1-13-7-9-15(10-8-13)21-16(11-18)19-20-17(21)22-12-14-5-3-2-4-6-14/h2-10H,11-12,18H2,1H3