ethyl 2-[2-[2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-(2-methoxy-2-oxo-ethyl)-3-oxo-piperazin-1-yl]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[2-(2-methoxy-2-oxoethyl)-3-oxo-1-piperazinyl]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(2-methoxy-2-oxoethyl)-3-oxopiperazin-1-yl]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[3-keto-2-(2-keto-2-methoxy-ethyl)piperazino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN3CCNC(=O)C3CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN3CCNC(=O)C3CC(=O)OC

InChI

InChI=1S/C22H25N3O6S/c1-3-31-22(29)19-15(14-7-5-4-6-8-14)13-32-21(19)24-17(26)12-25-10-9-23-20(28)16(25)11-18(27)30-2/h4-8,13,16H,3,9-12H2,1-2H3,(H,23,28)(H,24,26)