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

Systemtic Name: dodecyl 2-[3-oxidanylidene-1-(pentanoylcarbamothioyl)piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-(pentanoylcarbamothioyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[(1-oxopentylamino)-sulfanylidenemethyl]-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[3-oxo-1-(pentanoylcarbamothioyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(valerylthiocarbamoyl)piperazin-2-yl]acetic acid lauryl ester Formula: C24H43N3O4S MolecularWeight: 469.68092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H43N3O4S/c1-3-5-7-8-9-10-11-12-13-14-18-31-22(29)19-20-23(30)25-16-17-27(20)24(32)26-21(28)15-6-4-2/h20H,3-19H2,1-2H3,(H,25,30)(H,26,28,32)