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

Systemtic Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]methylideneamino]thiophene-2-carboxamide Openeye Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxo-quinazolin-3-yl)pyrrol-3-yl]methyleneamino]thiophene-2-carboxamide CAS Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxo-3-quinazolinyl)-3-pyrrolyl]methylideneamino]-2-thiophenecarboxamide IUPAC Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxoquinazolin-3-yl)pyrrol-3-yl]methylideneamino]thiophene-2-carboxamide Traditional Name: N-[[1-(4-keto-2-methyl-quinazolin-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]thiophene-2-carboxamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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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=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=NNC(=O)C4=CC=CS4

InChI

InChI=1S/C21H19N5O2S/c1-13-11-16(12-22-24-20(27)19-9-6-10-29-19)14(2)25(13)26-15(3)23-18-8-5-4-7-17(18)21(26)28/h4-12H,1-3H3,(H,24,27)