methyl N'-tert-butyl-N-[4-phenoxy-2,6-di(propan-2-yl)phenyl]carbamimidothioate

Systemtic Name: methyl N'-tert-butyl-N-[4-phenoxy-2,6-di(propan-2-yl)phenyl]carbamimidothioate Openeye Name: 3-tert-butyl-1-(2,6-diisopropyl-4-phenoxy-phenyl)-2-methyl-isothiourea CAS Name: N'-tert-butyl-N-[4-phenoxy-2,6-di(propan-2-yl)phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-tert-butyl-N-[4-phenoxy-2,6-di(propan-2-yl)phenyl]carbamimidothioate Traditional Name: 3-tert-butyl-1-(2,6-diisopropyl-4-phenoxy-phenyl)-2-methyl-isothiourea Formula: C24H34N2OS MolecularWeight: 398.60456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1NC(=NC(C)(C)C)SC)C(C)C)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC(=CC(=C1NC(=NC(C)(C)C)SC)C(C)C)OC2=CC=CC=C2

InChI

InChI=1S/C24H34N2OS/c1-16(2)20-14-19(27-18-12-10-9-11-13-18)15-21(17(3)4)22(20)25-23(28-8)26-24(5,6)7/h9-17H,1-8H3,(H,25,26)