7-azanyl-2-[5-(4-ethanoylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-azanyl-2-[5-(4-ethanoylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-6-nitro-1H-quinazolin-4-one Openeye Name: 2-[5-(4-acetylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-7-amino-6-nitro-1H-quinazolin-4-one CAS Name: 2-[5-[(4-acetyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]-7-amino-6-nitro-1H-quinazolin-4-one IUPAC Name: 2-[5-(4-acetylpiperazin-1-yl)sulfonyl-2-propoxyphenyl]-7-amino-6-nitro-1H-quinazolin-4-one Traditional Name: 2-[5-(4-acetylpiperazino)sulfonyl-2-propoxy-phenyl]-7-amino-6-nitro-1H-quinazolin-4-one Formula: C23H26N6O7S MolecularWeight: 530.55354

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C)C3=NC(=O)C4=CC(=C(C=C4N3)N)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C)C3=NC(=O)C4=CC(=C(C=C4N3)N)[N+](=O)[O-]

InChI

InChI=1S/C23H26N6O7S/c1-3-10-36-21-5-4-15(37(34,35)28-8-6-27(7-9-28)14(2)30)11-17(21)22-25-19-13-18(24)20(29(32)33)12-16(19)23(31)26-22/h4-5,11-13H,3,6-10,24H2,1-2H3,(H,25,26,31)