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

Systemtic Name: phenyl N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Openeye Name: 1-(2,2-dimethylpropyl)-1-[(4-hydroxyphenyl)methyl]-2-phenyl-isothiourea CAS Name: N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioic acid phenyl ester IUPAC Name: phenyl N-(2,2-dimethylpropyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Traditional Name: 1-(4-hydroxybenzyl)-1-neopentyl-2-phenyl-isothiourea Formula: C19H24N2OS MolecularWeight: 328.47166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2OS/c1-19(2,3)14-21(13-15-9-11-16(22)12-10-15)18(20)23-17-7-5-4-6-8-17/h4-12,20,22H,13-14H2,1-3H3