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

Systemtic Name: decyl N'-(4-methyl-5-oxidanylidene-1-phenyl-4H-imidazol-2-yl)carbamimidothioate Openeye Name: 2-decyl-3-(4-methyl-5-oxo-1-phenyl-4H-imidazol-2-yl)isothiourea CAS Name: N'-(4-methyl-5-oxo-1-phenyl-4H-imidazol-2-yl)carbamimidothioic acid decyl ester IUPAC Name: decyl N'-(4-methyl-5-oxo-1-phenyl-4H-imidazol-2-yl)carbamimidothioate Traditional Name: 2-decyl-3-(5-keto-4-methyl-1-phenyl-2-imidazolin-2-yl)isothiourea Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4OS/c1-3-4-5-6-7-8-9-13-16-27-20(22)24-21-23-17(2)19(26)25(21)18-14-11-10-12-15-18/h10-12,14-15,17H,3-9,13,16H2,1-2H3,(H2,22,23,24)