1-[(4-hydroxyphenyl)methyl]-1-[(3-methyl-2-oxidanyl-phenyl)methyl]-3-phenyl-thiourea

Systemtic Name: 1-[(4-hydroxyphenyl)methyl]-1-[(3-methyl-2-oxidanyl-phenyl)methyl]-3-phenyl-thiourea Openeye Name: 1-[(2-hydroxy-3-methyl-phenyl)methyl]-1-[(4-hydroxyphenyl)methyl]-3-phenyl-thiourea CAS Name: 1-[(2-hydroxy-3-methylphenyl)methyl]-1-[(4-hydroxyphenyl)methyl]-3-phenylthiourea IUPAC Name: 1-[(2-hydroxy-3-methylphenyl)methyl]-1-[(4-hydroxyphenyl)methyl]-3-phenylthiourea Traditional Name: 1-(4-hydroxybenzyl)-1-(2-hydroxy-3-methyl-benzyl)-3-phenyl-thiourea Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CN(CC2=CC=C(C=C2)O)C(=S)NC3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C(=CC=C1)CN(CC2=CC=C(C=C2)O)C(=S)NC3=CC=CC=C3)O

InChI

InChI=1S/C22H22N2O2S/c1-16-6-5-7-18(21(16)26)15-24(14-17-10-12-20(25)13-11-17)22(27)23-19-8-3-2-4-9-19/h2-13,25-26H,14-15H2,1H3,(H,23,27)