ethyl 2-[(E)-(4-bromophenyl)methylideneamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(E)-(4-bromophenyl)methylideneamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(E)-(4-bromophenyl)methyleneamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[(E)-(4-bromophenyl)methylideneamino]-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-(4-bromophenyl)methylideneamino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[(E)-(4-bromobenzylidene)amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H23BrN2O3S MolecularWeight: 451.37722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)N=CC2=CC=C(C=C2)Br)C(=O)OCC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)/N=C/C2=CC=C(C=C2)Br)C(=O)OCC)C

InChI

InChI=1S/C20H23BrN2O3S/c1-5-23(6-2)19(24)17-13(4)16(20(25)26-7-3)18(27-17)22-12-14-8-10-15(21)11-9-14/h8-12H,5-7H2,1-4H3/b22-12+