ethyl 2-[2-[(4-butylphenyl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(4-butylphenyl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-butylanilino)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-butylanilino)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-butylanilino)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-butylanilino)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H28N2O3S MolecularWeight: 436.56642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C25H28N2O3S/c1-3-5-9-18-12-14-20(15-13-18)26-16-22(28)27-24-23(25(29)30-4-2)21(17-31-24)19-10-7-6-8-11-19/h6-8,10-15,17,26H,3-5,9,16H2,1-2H3,(H,27,28)