[azanyl-[(4,6-dimethylquinazolin-2-yl)amino]methylidene]-(4-nitrophenyl)sulfonyl-azanium

Systemtic Name: [azanyl-[(4,6-dimethylquinazolin-2-yl)amino]methylidene]-(4-nitrophenyl)sulfonyl-azanium Openeye Name: [amino-[(4,6-dimethylquinazolin-2-yl)amino]methylene]-(4-nitrophenyl)sulfonyl-ammonium CAS Name: [amino-[(4,6-dimethyl-2-quinazolinyl)amino]methylidene]-(4-nitrophenyl)sulfonylammonium IUPAC Name: [amino-[(4,6-dimethylquinazolin-2-yl)amino]methylidene]-(4-nitrophenyl)sulfonylazanium Traditional Name: [amino-[(4,6-dimethylquinazolin-2-yl)amino]methylene]-nosyl-ammonium Formula: C17H17N6O4S+ MolecularWeight: 401.41968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C)NC(=[NH+]S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C)NC(=[NH+]S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])N

InChI

InChI=1S/C17H16N6O4S/c1-10-3-8-15-14(9-10)11(2)19-17(20-15)21-16(18)22-28(26,27)13-6-4-12(5-7-13)23(24)25/h3-9H,1-2H3,(H3,18,19,20,21,22)/p+1