propyl 4-[[2-(2-butan-2-yloxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]carbothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[2-(2-butan-2-yloxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]carbothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-oxo-4-[[3-oxo-2-(2-oxo-2-sec-butoxy-ethyl)piperazine-1-carbothioyl]amino]butanoate CAS Name: 4-[[[2-(2-butan-2-yloxy-2-oxoethyl)-3-oxo-1-piperazinyl]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[[2-(2-butan-2-yloxy-2-oxoethyl)-3-oxopiperazine-1-carbothioyl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[3-keto-2-(2-keto-2-sec-butoxy-ethyl)piperazine-1-carbothioyl]amino]butyric acid propyl ester Formula: C18H29N3O6S MolecularWeight: 415.50436

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)N1CCNC(=O)C1CC(=O)OC(C)CC

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)N1CCNC(=O)C1CC(=O)OC(C)CC

InChI

InChI=1S/C18H29N3O6S/c1-4-10-26-15(23)7-6-14(22)20-18(28)21-9-8-19-17(25)13(21)11-16(24)27-12(3)5-2/h12-13H,4-11H2,1-3H3,(H,19,25)(H,20,22,28)