dotriacontyl carbamimidothioate

Systemtic Name: dotriacontyl carbamimidothioate Openeye Name: 2-dotriacontylisothiourea CAS Name: carbamimidothioic acid dotriacontyl ester IUPAC Name: dotriacontyl carbamimidothioate Traditional Name: 2-dotriacontylisothiourea Formula: C33H68N2S MolecularWeight: 524.97142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCSC(=N)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCSC(=N)N

InChI

InChI=1S/C33H68N2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-36-33(34)35/h2-32H2,1H3,(H3,34,35)