ethyl 2-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(4-veratrylpiperazine-1-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H31N3O5S/c1-6-31-22(27)20-15(2)16(3)32-21(20)24-23(28)26-11-9-25(10-12-26)14-17-7-8-18(29-4)19(13-17)30-5/h7-8,13H,6,9-12,14H2,1-5H3,(H,24,28)