methyl N-(2,4-dimethylphenyl)-N'-(2-methylbut-3-yn-2-yl)carbamimidothioate

Systemtic Name: methyl N-(2,4-dimethylphenyl)-N'-(2-methylbut-3-yn-2-yl)carbamimidothioate Openeye Name: 1-(2,4-dimethylphenyl)-3-(1,1-dimethylprop-2-ynyl)-2-methyl-isothiourea CAS Name: N-(2,4-dimethylphenyl)-N'-(2-methylbut-3-yn-2-yl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(2,4-dimethylphenyl)-N'-(2-methylbut-3-yn-2-yl)carbamimidothioate Traditional Name: 1-(2,4-dimethylphenyl)-3-(1,1-dimethylprop-2-ynyl)-2-methyl-isothiourea Formula: C15H20N2S MolecularWeight: 260.3977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=NC(C)(C)C#C)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=NC(C)(C)C#C)SC)C

InChI

InChI=1S/C15H20N2S/c1-7-15(4,5)17-14(18-6)16-13-9-8-11(2)10-12(13)3/h1,8-10H,2-6H3,(H,16,17)