N2-(2-methylphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-methylphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(o-tolyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methylphenyl)-6-[(4-quinazolinylthio)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methylphenyl)-6-(quinazolin-4-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(quinazolin-4-ylthio)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C19H17N7S MolecularWeight: 375.45018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C19H17N7S/c1-12-6-2-4-8-14(12)23-19-25-16(24-18(20)26-19)10-27-17-13-7-3-5-9-15(13)21-11-22-17/h2-9,11H,10H2,1H3,(H3,20,23,24,25,26)