3-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 3-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: 3-(6-chloro-4-oxo-chromen-3-yl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: 3-(6-chloro-4-oxo-1-benzopyran-3-yl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: 3-(6-chloro-4-oxochromen-3-yl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: 3-(6-chloro-4-keto-chromen-3-yl)-2-cyano-N-(6-mesyl-1,3-benzothiazol-2-yl)acrylamide Formula: C21H12ClN3O5S2 MolecularWeight: 485.92008

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(=CC3=COC4=C(C3=O)C=C(C=C4)Cl)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(=CC3=COC4=C(C3=O)C=C(C=C4)Cl)C#N

InChI

InChI=1S/C21H12ClN3O5S2/c1-32(28,29)14-3-4-16-18(8-14)31-21(24-16)25-20(27)11(9-23)6-12-10-30-17-5-2-13(22)7-15(17)19(12)26/h2-8,10H,1H3,(H,24,25,27)