1-(4,7-dimethylquinazolin-2-yl)-2-(4-nitrophenyl)sulfonyl-guanidine

Systemtic Name: 1-(4,7-dimethylquinazolin-2-yl)-2-(4-nitrophenyl)sulfonyl-guanidine Openeye Name: 1-(4,7-dimethylquinazolin-2-yl)-2-(4-nitrophenyl)sulfonyl-guanidine CAS Name: 1-(4,7-dimethyl-2-quinazolinyl)-2-(4-nitrophenyl)sulfonylguanidine IUPAC Name: 1-(4,7-dimethylquinazolin-2-yl)-2-(4-nitrophenyl)sulfonylguanidine Traditional Name: 1-(4,7-dimethylquinazolin-2-yl)-2-nosyl-guanidine Formula: C17H16N6O4S MolecularWeight: 400.41174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)NC(=NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])N)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N/C(=N/S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])/N)C

InChI

InChI=1S/C17H16N6O4S/c1-10-3-8-14-11(2)19-17(20-15(14)9-10)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)