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

Systemtic Name: methyl N'-(2,4,5-trimethylphenyl)carbamimidothioate Openeye Name: 2-methyl-3-(2,4,5-trimethylphenyl)isothiourea CAS Name: N'-(2,4,5-trimethylphenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2,4,5-trimethylphenyl)carbamimidothioate Traditional Name: 2-methyl-3-(2,4,5-trimethylphenyl)isothiourea Formula: C11H16N2S MolecularWeight: 208.32314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)N=C(N)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1C)N=C(N)SC)C

InChI

InChI=1S/C11H16N2S/c1-7-5-9(3)10(6-8(7)2)13-11(12)14-4/h5-6H,1-4H3,(H2,12,13)