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

Systemtic Name: dodecyl 2-[1-(ethanoylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-(acetylcarbamothioyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[acetamido(sulfanylidene)methyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-(acetylcarbamothioyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(acetylthiocarbamoyl)-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C21H37N3O4S MolecularWeight: 427.60118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C

InChI

InChI=1S/C21H37N3O4S/c1-3-4-5-6-7-8-9-10-11-12-15-28-19(26)16-18-20(27)22-13-14-24(18)21(29)23-17(2)25/h18H,3-16H2,1-2H3,(H,22,27)(H,23,25,29)