ethyl 4-ethyl-5-methyl-2-[2-(3-oxidanylidenepiperazin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(3-oxidanylidenepiperazin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[2-(3-oxopiperazin-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-(3-oxo-1-piperazinyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-(3-oxopiperazin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-2-[[2-(3-ketopiperazino)acetyl]amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2CCNC(=O)C2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2CCNC(=O)C2)C

InChI

InChI=1S/C16H23N3O4S/c1-4-11-10(3)24-15(14(11)16(22)23-5-2)18-13(21)9-19-7-6-17-12(20)8-19/h4-9H2,1-3H3,(H,17,20)(H,18,21)