N-[[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]methylideneamino]-7-methoxy-5-nitro-1-benzofuran-2-carboxamide

Systemtic Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]methylideneamino]-7-methoxy-5-nitro-1-benzofuran-2-carboxamide Openeye Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxo-quinazolin-3-yl)pyrrol-3-yl]methyleneamino]-7-methoxy-5-nitro-benzofuran-2-carboxamide CAS Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxo-3-quinazolinyl)-3-pyrrolyl]methylideneamino]-7-methoxy-5-nitro-2-benzofurancarboxamide IUPAC Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxoquinazolin-3-yl)pyrrol-3-yl]methylideneamino]-7-methoxy-5-nitro-1-benzofuran-2-carboxamide Traditional Name: N-[[1-(4-keto-2-methyl-quinazolin-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-7-methoxy-5-nitro-coumarilamide Formula: C26H22N6O6 MolecularWeight: 514.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=NNC(=O)C4=CC5=CC(=CC(=C5O4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=NNC(=O)C4=CC5=CC(=CC(=C5O4)OC)[N+](=O)[O-]

InChI

InChI=1S/C26H22N6O6/c1-14-9-18(15(2)30(14)31-16(3)28-21-8-6-5-7-20(21)26(31)34)13-27-29-25(33)23-11-17-10-19(32(35)36)12-22(37-4)24(17)38-23/h5-13H,1-4H3,(H,29,33)