S-(8-oxidanyl-16-thiocyanato-hexadecyl) carbamothioate

Systemtic Name: S-(8-oxidanyl-16-thiocyanato-hexadecyl) carbamothioate Openeye Name: S-(8-hydroxy-16-thiocyanato-hexadecyl) carbamothioate CAS Name: carbamothioic acid S-(8-hydroxy-16-thiocyanatohexadecyl) ester IUPAC Name: S-(8-hydroxy-16-thiocyanatohexadecyl) carbamothioate Traditional Name: thiocarbamic acid S-(8-hydroxy-16-thiocyanato-hexadecyl) ester Formula: C18H34N2O2S2 MolecularWeight: 374.60476

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCSC#N)CCCC(CCCCCCCSC(=O)N)O

Isomeric SMILES

C(CCCCSC#N)CCCC(CCCCCCCSC(=O)N)O

InChI

InChI=1S/C18H34N2O2S2/c19-16-23-14-10-6-2-1-4-8-12-17(21)13-9-5-3-7-11-15-24-18(20)22/h17,21H,1-15H2,(H2,20,22)