3-[(2-methylphenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-methylphenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-isopropyl-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-[(2-methylphenyl)methylthio]-5-propan-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-methylphenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-isopropyl-5-[(2-methylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2N)C(C)C

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2N)C(C)C

InChI

InChI=1S/C13H18N4S/c1-9(2)12-15-16-13(17(12)14)18-8-11-7-5-4-6-10(11)3/h4-7,9H,8,14H2,1-3H3