butan-2-yl 2-[1-(ethanoylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: butan-2-yl 2-[1-(ethanoylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-(acetylcarbamothioyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[acetamido(sulfanylidene)methyl]-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-(acetylcarbamothioyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(acetylthiocarbamoyl)-3-keto-piperazin-2-yl]acetic acid sec-butyl ester Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C

Isomeric SMILES

CCC(C)OC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C

InChI

InChI=1S/C13H21N3O4S/c1-4-8(2)20-11(18)7-10-12(19)14-5-6-16(10)13(21)15-9(3)17/h8,10H,4-7H2,1-3H3,(H,14,19)(H,15,17,21)