2-(2,5-dimethylphenyl)imino-6-nitro-N-(1,3-thiazol-2-yl)chromene-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)imino-6-nitro-N-(1,3-thiazol-2-yl)chromene-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)imino-6-nitro-N-thiazol-2-yl-chromene-3-carboxamide CAS Name: 2-(2,5-dimethylphenyl)imino-6-nitro-N-(2-thiazolyl)-1-benzopyran-3-carboxamide IUPAC Name: 2-(2,5-dimethylphenyl)imino-6-nitro-N-(1,3-thiazol-2-yl)chromene-3-carboxamide Traditional Name: 2-(2,5-dimethylphenyl)imino-6-nitro-N-thiazol-2-yl-chromene-3-carboxamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N=C2C(=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])C(=O)NC4=NC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N=C2C(=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])C(=O)NC4=NC=CS4

InChI

InChI=1S/C21H16N4O4S/c1-12-3-4-13(2)17(9-12)23-20-16(19(26)24-21-22-7-8-30-21)11-14-10-15(25(27)28)5-6-18(14)29-20/h3-11H,1-2H3,(H,22,24,26)