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

Systemtic Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfonylethyl)quinazolin-4-amine Openeye Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfonylethyl)quinazolin-4-amine CAS Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfonylethyl)-4-quinazolinamine IUPAC Name: 2-(1H-1,4-diazepin-7-yl)-N-(2-methylsulfonylethyl)quinazolin-4-amine Traditional Name: [2-(1H-1,4-diazepin-7-yl)quinazolin-4-yl]-(2-mesylethyl)amine Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNC1=NC(=NC2=CC=CC=C21)C3=CC=NC=CN3

Isomeric SMILES

CS(=O)(=O)CCNC1=NC(=NC2=CC=CC=C21)C3=CC=NC=CN3

InChI

InChI=1S/C16H17N5O2S/c1-24(22,23)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)