7-azanyl-6-nitro-2-(2-propoxyphenyl)-1,4-dihydroquinazoline-4-sulfonamide

Systemtic Name: 7-azanyl-6-nitro-2-(2-propoxyphenyl)-1,4-dihydroquinazoline-4-sulfonamide Openeye Name: 7-amino-6-nitro-2-(2-propoxyphenyl)-1,4-dihydroquinazoline-4-sulfonamide CAS Name: 7-amino-6-nitro-2-(2-propoxyphenyl)-1,4-dihydroquinazoline-4-sulfonamide IUPAC Name: 7-amino-6-nitro-2-(2-propoxyphenyl)-1,4-dihydroquinazoline-4-sulfonamide Traditional Name: 7-amino-6-nitro-2-(2-propoxyphenyl)-1,4-dihydroquinazoline-4-sulfonamide Formula: C17H19N5O5S MolecularWeight: 405.42826

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(C3=CC(=C(C=C3N2)N)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(C3=CC(=C(C=C3N2)N)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C17H19N5O5S/c1-2-7-27-15-6-4-3-5-10(15)16-20-13-9-12(18)14(22(23)24)8-11(13)17(21-16)28(19,25)26/h3-6,8-9,17H,2,7,18H2,1H3,(H,20,21)(H2,19,25,26)