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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2N)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2N)C(C)C

InChI

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