6-[(3-methylphenyl)sulfanylmethyl]quinazoline-2,4-diamine

Systemtic Name: 6-[(3-methylphenyl)sulfanylmethyl]quinazoline-2,4-diamine Openeye Name: 6-(m-tolylsulfanylmethyl)quinazoline-2,4-diamine CAS Name: 6-[[(3-methylphenyl)thio]methyl]quinazoline-2,4-diamine IUPAC Name: 6-[(3-methylphenyl)sulfanylmethyl]quinazoline-2,4-diamine Traditional Name: [2-amino-6-[(m-tolylthio)methyl]quinazolin-4-yl]amine Formula: C16H16N4S MolecularWeight: 296.39004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SCC2=CC3=C(C=C2)N=C(N=C3N)N

Isomeric SMILES

CC1=CC(=CC=C1)SCC2=CC3=C(C=C2)N=C(N=C3N)N

InChI

InChI=1S/C16H16N4S/c1-10-3-2-4-12(7-10)21-9-11-5-6-14-13(8-11)15(17)20-16(18)19-14/h2-8H,9H2,1H3,(H4,17,18,19,20)