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

Systemtic Name: methyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dimethylphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dimethylphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2-bromoanilino)-oxomethyl]amino]-4-(2,4-dimethylphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dimethylphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-bromophenyl)carbamoylamino]-4-(2,4-dimethylphenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H21BrN2O3S MolecularWeight: 473.38274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)NC3=CC=CC=C3Br)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)NC3=CC=CC=C3Br)C)C

InChI

InChI=1S/C22H21BrN2O3S/c1-12-9-10-15(13(2)11-12)18-14(3)29-20(19(18)21(26)28-4)25-22(27)24-17-8-6-5-7-16(17)23/h5-11H,1-4H3,(H2,24,25,27)