methyl N'-(3-methoxypropyl)-N-(2,4,5-trimethylphenyl)carbamimidothioate

Systemtic Name: methyl N'-(3-methoxypropyl)-N-(2,4,5-trimethylphenyl)carbamimidothioate Openeye Name: 3-(3-methoxypropyl)-2-methyl-1-(2,4,5-trimethylphenyl)isothiourea CAS Name: N'-(3-methoxypropyl)-N-(2,4,5-trimethylphenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(3-methoxypropyl)-N-(2,4,5-trimethylphenyl)carbamimidothioate Traditional Name: 3-(3-methoxypropyl)-2-methyl-1-(2,4,5-trimethylphenyl)isothiourea Formula: C15H24N2OS MolecularWeight: 280.42886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=NCCCOC)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=NCCCOC)SC)C

InChI

InChI=1S/C15H24N2OS/c1-11-9-13(3)14(10-12(11)2)17-15(19-5)16-7-6-8-18-4/h9-10H,6-8H2,1-5H3,(H,16,17)