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

Systemtic Name: phenethyl 2-[1-(ethylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: phenethyl 2-[1-(ethylcarbamothioyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[ethylamino(sulfanylidene)methyl]-3-oxo-2-piperazinyl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[1-(ethylcarbamothioyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(ethylthiocarbamoyl)-3-keto-piperazin-2-yl]acetic acid phenethyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CCNC(=S)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O3S/c1-2-18-17(24)20-10-9-19-16(22)14(20)12-15(21)23-11-8-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H,18,24)(H,19,22)