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

Systemtic Name: methyl 2-[(2-azanylidene-8-methoxy-chromen-3-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[(2-imino-8-methoxy-chromene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(2-imino-8-methoxy-1-benzopyran-3-yl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[(2-imino-8-methoxychromene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(2-imino-8-methoxy-chromene-3-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C23H17BrN2O5S MolecularWeight: 513.36048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=N)C(=C2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)OC

Isomeric SMILES

COC1=CC=CC2=C1OC(=N)C(=C2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C23H17BrN2O5S/c1-29-17-5-3-4-13-10-15(20(25)31-19(13)17)21(27)26-22-18(23(28)30-2)16(11-32-22)12-6-8-14(24)9-7-12/h3-11,25H,1-2H3,(H,26,27)