N-methyl-2-[2-(phenylsulfonyl)ethylsulfanyl]quinazolin-4-amine

Systemtic Name: N-methyl-2-[2-(phenylsulfonyl)ethylsulfanyl]quinazolin-4-amine Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-methyl-quinazolin-4-amine CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-methyl-4-quinazolinamine IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-methylquinazolin-4-amine Traditional Name: [2-(2-besylethylthio)quinazolin-4-yl]-methyl-amine Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=CC=CC=C21)SCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC1=NC(=NC2=CC=CC=C21)SCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S2/c1-18-16-14-9-5-6-10-15(14)19-17(20-16)23-11-12-24(21,22)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,18,19,20)