1-[(4-tert-butylphenyl)methyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3-[(4-hydroxy-3-methoxy-phenyl)methyl]thiourea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea Traditional Name: 1-(4-tert-butylbenzyl)-3-vanillyl-thiourea Formula: C20H26N2O2S MolecularWeight: 358.49764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NCC2=CC(=C(C=C2)O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NCC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C20H26N2O2S/c1-20(2,3)16-8-5-14(6-9-16)12-21-19(25)22-13-15-7-10-17(23)18(11-15)24-4/h5-11,23H,12-13H2,1-4H3,(H2,21,22,25)