[azanyl-[(4-methylquinazolin-2-yl)amino]methylidene]-(phenylsulfonyl)azanium

Systemtic Name: [azanyl-[(4-methylquinazolin-2-yl)amino]methylidene]-(phenylsulfonyl)azanium Openeye Name: [amino-[(4-methylquinazolin-2-yl)amino]methylene]-(benzenesulfonyl)ammonium CAS Name: [amino-[(4-methyl-2-quinazolinyl)amino]methylidene]-(benzenesulfonyl)ammonium IUPAC Name: [amino-[(4-methylquinazolin-2-yl)amino]methylidene]-(benzenesulfonyl)azanium Traditional Name: [amino-[(4-methylquinazolin-2-yl)amino]methylene]-besyl-ammonium Formula: C16H16N5O2S+ MolecularWeight: 342.39554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC(=[NH+]S(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC(=[NH+]S(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C16H15N5O2S/c1-11-13-9-5-6-10-14(13)19-16(18-11)20-15(17)21-24(22,23)12-7-3-2-4-8-12/h2-10H,1H3,(H3,17,18,19,20,21)/p+1