(4-tert-butyl-2,6-dimethyl-phenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3-[(2-methoxyphenyl)methyl]isothiourea CAS Name: N'-[(2-methoxyphenyl)methyl]carbamimidothioic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 2-(4-tert-butyl-2,6-dimethyl-benzyl)-3-o-anisyl-isothiourea Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC(=NCC2=CC=CC=C2OC)N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC(=NCC2=CC=CC=C2OC)N)C)C(C)(C)C

InChI

InChI=1S/C22H30N2OS/c1-15-11-18(22(3,4)5)12-16(2)19(15)14-26-21(23)24-13-17-9-7-8-10-20(17)25-6/h7-12H,13-14H2,1-6H3,(H2,23,24)