(4-tert-butyl-2,6-dimethyl-phenyl)methyl N'-(2-methylpropyl)carbamimidothioate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl N'-(2-methylpropyl)carbamimidothioate Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3-isobutyl-isothiourea CAS Name: N'-(2-methylpropyl)carbamimidothioic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl N'-(2-methylpropyl)carbamimidothioate Traditional Name: 2-(4-tert-butyl-2,6-dimethyl-benzyl)-3-isobutyl-isothiourea Formula: C18H30N2S MolecularWeight: 306.5092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC(=NCC(C)C)N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC(=NCC(C)C)N)C)C(C)(C)C

InChI

InChI=1S/C18H30N2S/c1-12(2)10-20-17(19)21-11-16-13(3)8-15(9-14(16)4)18(5,6)7/h8-9,12H,10-11H2,1-7H3,(H2,19,20)