2-[5-[(3-methylphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[5-[(3-methylphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-[4-benzyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-[5-[(3-methylphenyl)methylthio]-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-[4-benzyl-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethanamine Traditional Name: 2-[4-benzyl-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]ethylamine Formula: C19H22N4S MolecularWeight: 338.46978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2CC3=CC=CC=C3)CCN

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2CC3=CC=CC=C3)CCN

InChI

InChI=1S/C19H22N4S/c1-15-6-5-9-17(12-15)14-24-19-22-21-18(10-11-20)23(19)13-16-7-3-2-4-8-16/h2-9,12H,10-11,13-14,20H2,1H3