propyl N-(2,4-dimethylphenyl)-N'-methyl-carbamimidothioate

Systemtic Name: propyl N-(2,4-dimethylphenyl)-N'-methyl-carbamimidothioate Openeye Name: 1-(2,4-dimethylphenyl)-3-methyl-2-propyl-isothiourea CAS Name: N-(2,4-dimethylphenyl)-N'-methylcarbamimidothioic acid propyl ester IUPAC Name: propyl N-(2,4-dimethylphenyl)-N'-methylcarbamimidothioate Traditional Name: 1-(2,4-dimethylphenyl)-3-methyl-2-propyl-isothiourea Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=NC)NC1=C(C=C(C=C1)C)C

Isomeric SMILES

CCCSC(=NC)NC1=C(C=C(C=C1)C)C

InChI

InChI=1S/C13H20N2S/c1-5-8-16-13(14-4)15-12-7-6-10(2)9-11(12)3/h6-7,9H,5,8H2,1-4H3,(H,14,15)