(phenylmethyl) N,N-bis[(4-methoxyphenyl)methyl]-N'-(3-methylphenyl)carbamimidothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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