2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfanylethyl)quinazolin-4-amine

Systemtic Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfanylethyl)quinazolin-4-amine Openeye Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfanylethyl)quinazolin-4-amine CAS Name: 2-(1H-1,4-diazepin-7-yl)-N-[2-(methylthio)ethyl]-4-quinazolinamine IUPAC Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfanylethyl)quinazolin-4-amine Traditional Name: [2-(1H-1,4-diazepin-7-yl)quinazolin-4-yl]-[2-(methylthio)ethyl]amine Formula: C16H17N5S MolecularWeight: 311.40468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCNC1=NC(=NC2=CC=CC=C21)C3=CC=NC=CN3

Isomeric SMILES

CSCCNC1=NC(=NC2=CC=CC=C21)C3=CC=NC=CN3

InChI

InChI=1S/C16H17N5S/c1-22-11-10-19-15-12-4-2-3-5-13(12)20-16(21-15)14-6-7-17-8-9-18-14/h2-9,18H,10-11H2,1H3,(H,19,20,21)