N4-(3-methylphenyl)-7-methylsulfanyl-quinazoline-4,6-diamine

Systemtic Name: N4-(3-methylphenyl)-7-methylsulfanyl-quinazoline-4,6-diamine Openeye Name: 7-methylsulfanyl-N4-(m-tolyl)quinazoline-4,6-diamine CAS Name: N4-(3-methylphenyl)-7-(methylthio)quinazoline-4,6-diamine IUPAC Name: 4-N-(3-methylphenyl)-7-methylsulfanylquinazoline-4,6-diamine Traditional Name: [6-amino-7-(methylthio)quinazolin-4-yl]-(m-tolyl)amine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)N)SC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)N)SC

InChI

InChI=1S/C16H16N4S/c1-10-4-3-5-11(6-10)20-16-12-7-13(17)15(21-2)8-14(12)18-9-19-16/h3-9H,17H2,1-2H3,(H,18,19,20)