ethyl 4-[2-[(2-ethoxycarbonyl-5-phenyl-thiophen-3-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(2-ethoxycarbonyl-5-phenyl-thiophen-3-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(2-ethoxycarbonyl-5-phenyl-3-thienyl)amino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[(2-ethoxycarbonyl-5-phenyl-3-thiophenyl)amino]-2-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2-ethoxycarbonyl-5-phenylthiophen-3-yl)amino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2-carbethoxy-5-phenyl-3-thienyl)amino]-2-keto-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H27N3O5S/c1-3-29-21(27)20-17(14-18(31-20)16-8-6-5-7-9-16)23-19(26)15-24-10-12-25(13-11-24)22(28)30-4-2/h5-9,14H,3-4,10-13,15H2,1-2H3,(H,23,26)