(phenylmethyl) N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-methylphenyl)carbamimidothioate

Systemtic Name: (phenylmethyl) N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-methylphenyl)carbamimidothioate Openeye Name: 2-benzyl-1,1-bis[(4-methoxyphenyl)methyl]-3-(p-tolyl)isothiourea CAS Name: N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-methylphenyl)carbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-methylphenyl)carbamimidothioate Traditional Name: 2-benzyl-1,1-bis(p-anisyl)-3-(p-tolyl)isothiourea Formula: C31H32N2O2S MolecularWeight: 496.66298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H32N2O2S/c1-24-9-15-28(16-10-24)32-31(36-23-27-7-5-4-6-8-27)33(21-25-11-17-29(34-2)18-12-25)22-26-13-19-30(35-3)20-14-26/h4-20H,21-23H2,1-3H3