3-[(2-fluoranyl-5-nitro-phenyl)amino]-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Systemtic Name: 3-[(2-fluoranyl-5-nitro-phenyl)amino]-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(2-fluoro-5-nitro-anilino)-2-[4-(2-oxochromen-3-yl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-(2-fluoro-5-nitroanilino)-2-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-(2-fluoro-5-nitroanilino)-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(2-fluoro-5-nitro-anilino)-2-[4-(2-ketochromen-3-yl)thiazol-2-yl]acrylonitrile Formula: C21H11FN4O4S MolecularWeight: 434.399843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)C(=CNC4=C(C=CC(=C4)[N+](=O)[O-])F)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)C(=CNC4=C(C=CC(=C4)[N+](=O)[O-])F)C#N

InChI

InChI=1S/C21H11FN4O4S/c22-16-6-5-14(26(28)29)8-17(16)24-10-13(9-23)20-25-18(11-31-20)15-7-12-3-1-2-4-19(12)30-21(15)27/h1-8,10-11,24H