methyl 2-[[2-azanylidene-7-(diethylamino)chromen-3-yl]carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-azanylidene-7-(diethylamino)chromen-3-yl]carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[[7-(diethylamino)-2-imino-chromene-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[[7-(diethylamino)-2-imino-1-benzopyran-3-yl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[[7-(diethylamino)-2-iminochromene-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[7-(diethylamino)-2-imino-chromene-3-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C26H24BrN3O4S MolecularWeight: 554.45546

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=N)O2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=N)O2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C26H24BrN3O4S/c1-4-30(5-2)18-11-8-16-12-19(23(28)34-21(16)13-18)24(31)29-25-22(26(32)33-3)20(14-35-25)15-6-9-17(27)10-7-15/h6-14,28H,4-5H2,1-3H3,(H,29,31)