S-methoxy N-[2-[(2-methyl-4-phenyl-butan-2-yl)diazenyl]propan-2-yl]carbamothioate

Systemtic Name: S-methoxy N-[2-[(2-methyl-4-phenyl-butan-2-yl)diazenyl]propan-2-yl]carbamothioate Openeye Name: S-methoxy N-[1-(1,1-dimethyl-3-phenyl-propyl)azo-1-methyl-ethyl]carbamothioate CAS Name: [2-(2-methyl-4-phenylbutan-2-yl)azopropan-2-ylamino]-oxomethanesulfenic acid methyl ester IUPAC Name: S-methoxy N-[2-[(2-methyl-4-phenylbutan-2-yl)diazenyl]propan-2-yl]carbamothioate Traditional Name: N-[1-(1,1-dimethyl-3-phenyl-propyl)azo-1-methyl-ethyl]thiocarbamic acid S-methoxy ester Formula: C16H25N3O2S MolecularWeight: 323.4536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=CC=C1)N=NC(C)(C)NC(=O)SOC

Isomeric SMILES

CC(C)(CCC1=CC=CC=C1)N=NC(C)(C)NC(=O)SOC

InChI

InChI=1S/C16H25N3O2S/c1-15(2,12-11-13-9-7-6-8-10-13)18-19-16(3,4)17-14(20)22-21-5/h6-10H,11-12H2,1-5H3,(H,17,20)