tert-butyl 4-[2-[(5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[(5-ethoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[(5-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[(5-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(5-carbethoxy-4-methyl-2-thienyl)amino]-2-keto-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2CCN(CC2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2CCN(CC2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H29N3O5S/c1-6-26-17(24)16-13(2)11-15(28-16)20-14(23)12-21-7-9-22(10-8-21)18(25)27-19(3,4)5/h11H,6-10,12H2,1-5H3,(H,20,23)