methyl 2-(3-oxidanylidene-1-propanethioyl-piperazin-2-yl)ethanoate

Systemtic Name: methyl 2-(3-oxidanylidene-1-propanethioyl-piperazin-2-yl)ethanoate Openeye Name: methyl 2-(3-oxo-1-propanethioyl-piperazin-2-yl)acetate CAS Name: 2-[3-oxo-1-(1-sulfanylidenepropyl)-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(3-oxo-1-propanethioylpiperazin-2-yl)acetate Traditional Name: 2-(3-keto-1-propanethioyl-piperazin-2-yl)acetic acid methyl ester Formula: C10H16N2O3S MolecularWeight: 244.31064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)N1CCNC(=O)C1CC(=O)OC

Isomeric SMILES

CCC(=S)N1CCNC(=O)C1CC(=O)OC

InChI

InChI=1S/C10H16N2O3S/c1-3-8(16)12-5-4-11-10(14)7(12)6-9(13)15-2/h7H,3-6H2,1-2H3,(H,11,14)