methyl 2-[(6-chloranyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(6-chloranyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(6-chloro-2-oxo-chromene-3-carbonyl)amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(6-chloro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-4-(4-cyclohexylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(6-chloro-2-oxochromene-3-carbonyl)amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(6-chloro-2-keto-chromene-3-carbonyl)amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C28H24ClNO5S MolecularWeight: 522.01186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3CCCCC3)NC(=O)C4=CC5=C(C=CC(=C5)Cl)OC4=O

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3CCCCC3)NC(=O)C4=CC5=C(C=CC(=C5)Cl)OC4=O

InChI

InChI=1S/C28H24ClNO5S/c1-34-28(33)24-22(18-9-7-17(8-10-18)16-5-3-2-4-6-16)15-36-26(24)30-25(31)21-14-19-13-20(29)11-12-23(19)35-27(21)32/h7-16H,2-6H2,1H3,(H,30,31)