(phenylmethyl) N,N-bis[(4-methoxyphenyl)methyl]-N'-(2-methyl-6-propan-2-yl-phenyl)carbamimidothioate

Systemtic Name: (phenylmethyl) N,N-bis[(4-methoxyphenyl)methyl]-N'-(2-methyl-6-propan-2-yl-phenyl)carbamimidothioate Openeye Name: 2-benzyl-3-(2-isopropyl-6-methyl-phenyl)-1,1-bis[(4-methoxyphenyl)methyl]isothiourea CAS Name: N,N-bis[(4-methoxyphenyl)methyl]-N'-(2-methyl-6-propan-2-ylphenyl)carbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N,N-bis[(4-methoxyphenyl)methyl]-N'-(2-methyl-6-propan-2-ylphenyl)carbamimidothioate Traditional Name: 2-benzyl-3-(2-isopropyl-6-methyl-phenyl)-1,1-bis(p-anisyl)isothiourea Formula: C34H38N2O2S MolecularWeight: 538.74272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)N=C(N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)N=C(N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC)SCC4=CC=CC=C4

InChI

InChI=1S/C34H38N2O2S/c1-25(2)32-13-9-10-26(3)33(32)35-34(39-24-29-11-7-6-8-12-29)36(22-27-14-18-30(37-4)19-15-27)23-28-16-20-31(38-5)21-17-28/h6-21,25H,22-24H2,1-5H3