2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]quinazolin-4-yl]amine Formula: C12H12N6S MolecularWeight: 272.32888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N

Isomeric SMILES

CN1C=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N

InChI

InChI=1S/C12H12N6S/c1-18-7-14-17-12(18)19-6-10-15-9-5-3-2-4-8(9)11(13)16-10/h2-5,7H,6H2,1H3,(H2,13,15,16)