sodium [3-(butylamino)-6-chloranyl-octadecyl] ethanimidothioate

Systemtic Name: sodium [3-(butylamino)-6-chloranyl-octadecyl] ethanimidothioate Openeye Name: sodium [3-(butylamino)-6-chloro-octadecyl] ethanimidothioate CAS Name: sodium ethanimidothioic acid [3-(butylamino)-6-chlorooctadecyl] ester IUPAC Name: sodium [3-(butylamino)-6-chlorooctadecyl] ethanimidothioate Traditional Name: sodium thioacetimidic acid [3-(butylamino)-6-chloro-octadecyl] ester Formula: C24H49ClN2NaS+ MolecularWeight: 456.16703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC(CCSC(=N)C)NCCCC)Cl.[Na+]

Isomeric SMILES

CCCCCCCCCCCCC(CCC(CCSC(=N)C)NCCCC)Cl.[Na+]

InChI

InChI=1S/C24H49ClN2S.Na/c1-4-6-8-9-10-11-12-13-14-15-16-23(25)17-18-24(27-20-7-5-2)19-21-28-22(3)26;/h23-24,26-27H,4-21H2,1-3H3;/q;+1