3-[(4-propan-2-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[(4-propan-2-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(4-isopropylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[(4-propan-2-ylphenyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(4-propan-2-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(4-isopropylbenzyl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NNC(=N2)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NNC(=N2)N

InChI

InChI=1S/C12H16N4S/c1-8(2)10-5-3-9(4-6-10)7-17-12-14-11(13)15-16-12/h3-6,8H,7H2,1-2H3,(H3,13,14,15,16)