(4-methylphenyl) N-butyl-N-[(4-hydroxyphenyl)methyl]carbamimidothioate

Systemtic Name: (4-methylphenyl) N-butyl-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Openeye Name: 1-butyl-1-[(4-hydroxyphenyl)methyl]-2-(p-tolyl)isothiourea CAS Name: N-butyl-N-[(4-hydroxyphenyl)methyl]carbamimidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) N-butyl-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Traditional Name: 1-butyl-1-(4-hydroxybenzyl)-2-(p-tolyl)isothiourea Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2OS/c1-3-4-13-21(14-16-7-9-17(22)10-8-16)19(20)23-18-11-5-15(2)6-12-18/h5-12,20,22H,3-4,13-14H2,1-2H3