decyl N'-(4-ethyl-5-oxidanylidene-1-phenyl-4H-imidazol-2-yl)carbamimidothioate

Systemtic Name: decyl N'-(4-ethyl-5-oxidanylidene-1-phenyl-4H-imidazol-2-yl)carbamimidothioate Openeye Name: 2-decyl-3-(4-ethyl-5-oxo-1-phenyl-4H-imidazol-2-yl)isothiourea CAS Name: N'-(4-ethyl-5-oxo-1-phenyl-4H-imidazol-2-yl)carbamimidothioic acid decyl ester IUPAC Name: decyl N'-(4-ethyl-5-oxo-1-phenyl-4H-imidazol-2-yl)carbamimidothioate Traditional Name: 2-decyl-3-(4-ethyl-5-keto-1-phenyl-2-imidazolin-2-yl)isothiourea Formula: C22H34N4OS MolecularWeight: 402.59656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC(=NC1=NC(C(=O)N1C2=CC=CC=C2)CC)N

Isomeric SMILES

CCCCCCCCCCS/C(=N\C1=NC(C(=O)N1C2=CC=CC=C2)CC)/N

InChI

InChI=1S/C22H34N4OS/c1-3-5-6-7-8-9-10-14-17-28-21(23)25-22-24-19(4-2)20(27)26(22)18-15-12-11-13-16-18/h11-13,15-16,19H,3-10,14,17H2,1-2H3,(H2,23,24,25)