2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-amine

Systemtic Name: 2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-amine Openeye Name: 2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-amine CAS Name: 2-[(1H-1,2,4-triazol-5-ylthio)methyl]-4-quinazolinamine IUPAC Name: 2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-amine Traditional Name: [2-[(1H-1,2,4-triazol-5-ylthio)methyl]quinazolin-4-yl]amine Formula: C11H10N6S MolecularWeight: 258.3023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NC=NN3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NC=NN3)N

InChI

InChI=1S/C11H10N6S/c12-10-7-3-1-2-4-8(7)15-9(16-10)5-18-11-13-6-14-17-11/h1-4,6H,5H2,(H2,12,15,16)(H,13,14,17)