ethyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dichlorophenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dichlorophenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dichlorophenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2-bromoanilino)-oxomethyl]amino]-4-(2,4-dichlorophenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dichlorophenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dichlorophenyl)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H17BrCl2N2O3S MolecularWeight: 528.24628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=C(C=C(C=C2)Cl)Cl)C)NC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=C(C=C(C=C2)Cl)Cl)C)NC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C21H17BrCl2N2O3S/c1-3-29-20(27)18-17(13-9-8-12(23)10-15(13)24)11(2)30-19(18)26-21(28)25-16-7-5-4-6-14(16)22/h4-10H,3H2,1-2H3,(H2,25,26,28)