3-[3-(4-chlorophenyl)-2-methyl-propyl]-1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-1-phenylmethoxy-thiourea

Systemtic Name: 3-[3-(4-chlorophenyl)-2-methyl-propyl]-1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-1-phenylmethoxy-thiourea Openeye Name: 1-benzyloxy-3-[3-(4-chlorophenyl)-2-methyl-propyl]-1-[(4-hydroxy-3-methoxy-phenyl)methyl]thiourea CAS Name: 3-[3-(4-chlorophenyl)-2-methylpropyl]-1-[(4-hydroxy-3-methoxyphenyl)methyl]-1-phenylmethoxythiourea IUPAC Name: 3-[3-(4-chlorophenyl)-2-methylpropyl]-1-[(4-hydroxy-3-methoxyphenyl)methyl]-1-phenylmethoxythiourea Traditional Name: 1-benzoxy-3-[3-(4-chlorophenyl)-2-methyl-propyl]-1-vanillyl-thiourea Formula: C26H29ClN2O3S MolecularWeight: 485.03806

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)Cl)CNC(=S)N(CC2=CC(=C(C=C2)O)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC(CC1=CC=C(C=C1)Cl)CNC(=S)N(CC2=CC(=C(C=C2)O)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29ClN2O3S/c1-19(14-20-8-11-23(27)12-9-20)16-28-26(33)29(32-18-21-6-4-3-5-7-21)17-22-10-13-24(30)25(15-22)31-2/h3-13,15,19,30H,14,16-18H2,1-2H3,(H,28,33)