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

Systemtic Name: (phenylmethyl) N'-(4-ethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 2-benzyl-3-(4-ethylphenyl)-1,1-bis[(4-methoxyphenyl)methyl]isothiourea CAS Name: N'-(4-ethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N'-(4-ethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 2-benzyl-3-(4-ethylphenyl)-1,1-bis(p-anisyl)isothiourea Formula: C32H34N2O2S MolecularWeight: 510.68956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=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

CCC1=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/C32H34N2O2S/c1-4-25-10-16-29(17-11-25)33-32(37-24-28-8-6-5-7-9-28)34(22-26-12-18-30(35-2)19-13-26)23-27-14-20-31(36-3)21-15-27/h5-21H,4,22-24H2,1-3H3