3-methylbutyl 2-[1-(ethylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[1-(ethylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[1-(ethylcarbamothioyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[ethylamino(sulfanylidene)methyl]-3-oxo-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[1-(ethylcarbamothioyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(ethylthiocarbamoyl)-3-keto-piperazin-2-yl]acetic acid isoamyl ester Formula: C14H25N3O3S MolecularWeight: 315.4316

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCNC(=O)C1CC(=O)OCCC(C)C

Isomeric SMILES

CCNC(=S)N1CCNC(=O)C1CC(=O)OCCC(C)C

InChI

InChI=1S/C14H25N3O3S/c1-4-15-14(21)17-7-6-16-13(19)11(17)9-12(18)20-8-5-10(2)3/h10-11H,4-9H2,1-3H3,(H,15,21)(H,16,19)