1-(phenylmethyl)-3-[(2,4,5-trimethoxyphenyl)methyl]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[(2,4,5-trimethoxyphenyl)methyl]thiourea Openeye Name: 1-benzyl-3-[(2,4,5-trimethoxyphenyl)methyl]thiourea CAS Name: 1-(phenylmethyl)-3-[(2,4,5-trimethoxyphenyl)methyl]thiourea IUPAC Name: 1-benzyl-3-[(2,4,5-trimethoxyphenyl)methyl]thiourea Traditional Name: 1-benzyl-3-(2,4,5-trimethoxybenzyl)thiourea Formula: C18H22N2O3S MolecularWeight: 346.44388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=S)NCC2=CC=CC=C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=S)NCC2=CC=CC=C2)OC)OC

InChI

InChI=1S/C18H22N2O3S/c1-21-15-10-17(23-3)16(22-2)9-14(15)12-20-18(24)19-11-13-7-5-4-6-8-13/h4-10H,11-12H2,1-3H3,(H2,19,20,24)