methyl 2-[(2-azanylidene-8-oxidanyl-chromen-3-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-azanylidene-8-oxidanyl-chromen-3-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[(8-hydroxy-2-imino-chromene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(8-hydroxy-2-imino-1-benzopyran-3-yl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[(8-hydroxy-2-iminochromene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(8-hydroxy-2-imino-chromene-3-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C22H15BrN2O5S MolecularWeight: 499.3339

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC4=C(C(=CC=C4)O)OC3=N

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC4=C(C(=CC=C4)O)OC3=N

InChI

InChI=1S/C22H15BrN2O5S/c1-29-22(28)17-15(11-5-7-13(23)8-6-11)10-31-21(17)25-20(27)14-9-12-3-2-4-16(26)18(12)30-19(14)24/h2-10,24,26H,1H3,(H,25,27)