(4-chlorophenyl) N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate

Systemtic Name: (4-chlorophenyl) N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Openeye Name: 2-(4-chlorophenyl)-1-(2,2-dimethylpropyl)-1-[(4-hydroxyphenyl)methyl]isothiourea CAS Name: N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Traditional Name: 2-(4-chlorophenyl)-1-(4-hydroxybenzyl)-1-neopentyl-isothiourea Formula: C19H23ClN2OS MolecularWeight: 362.91672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN(CC1=CC=C(C=C1)O)C(=N)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)CN(CC1=CC=C(C=C1)O)C(=N)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H23ClN2OS/c1-19(2,3)13-22(12-14-4-8-16(23)9-5-14)18(21)24-17-10-6-15(20)7-11-17/h4-11,21,23H,12-13H2,1-3H3