methyl N-(2,4-dimethylphenyl)-N'-(furan-2-ylmethyl)carbamimidothioate

Systemtic Name: methyl N-(2,4-dimethylphenyl)-N'-(furan-2-ylmethyl)carbamimidothioate Openeye Name: 1-(2,4-dimethylphenyl)-3-(2-furylmethyl)-2-methyl-isothiourea CAS Name: N-(2,4-dimethylphenyl)-N'-(2-furanylmethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(2,4-dimethylphenyl)-N'-(furan-2-ylmethyl)carbamimidothioate Traditional Name: 1-(2,4-dimethylphenyl)-3-(2-furfuryl)-2-methyl-isothiourea Formula: C15H18N2OS MolecularWeight: 274.38122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=NCC2=CC=CO2)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=NCC2=CC=CO2)SC)C

InChI

InChI=1S/C15H18N2OS/c1-11-6-7-14(12(2)9-11)17-15(19-3)16-10-13-5-4-8-18-13/h4-9H,10H2,1-3H3,(H,16,17)