S-phenylazanyl N-[2-(cyclohexyldiazenyl)propan-2-ylcarbamoylamino]carbamothioate

Systemtic Name: S-phenylazanyl N-[2-(cyclohexyldiazenyl)propan-2-ylcarbamoylamino]carbamothioate Openeye Name: S-anilino N-[(1-cyclohexylazo-1-methyl-ethyl)carbamoylamino]carbamothioate CAS Name: N-[[(2-cyclohexylazopropan-2-ylamino)-oxomethyl]amino]carbamothioic acid S-anilino ester IUPAC Name: S-anilino N-[2-(cyclohexyldiazenyl)propan-2-ylcarbamoylamino]carbamothioate Traditional Name: N-[(1-cyclohexylazo-1-methyl-ethyl)carbamoylamino]thiocarbamic acid S-anilino ester Formula: C17H26N6O2S MolecularWeight: 378.49234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(NC(=O)NNC(=O)SNC1=CC=CC=C1)N=NC2CCCCC2

Isomeric SMILES

CC(C)(NC(=O)NNC(=O)SNC1=CC=CC=C1)N=NC2CCCCC2

InChI

InChI=1S/C17H26N6O2S/c1-17(2,23-19-13-9-5-3-6-10-13)18-15(24)20-21-16(25)26-22-14-11-7-4-8-12-14/h4,7-8,11-13,22H,3,5-6,9-10H2,1-2H3,(H,21,25)(H2,18,20,24)