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

Systemtic Name: methyl N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-phenylazanylphenyl)carbamimidothioate Openeye Name: 3-(4-anilinophenyl)-1,1-bis[(4-methoxyphenyl)methyl]-2-methyl-isothiourea CAS Name: N'-(4-anilinophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(4-anilinophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 3-(4-anilinophenyl)-2-methyl-1,1-bis(p-anisyl)isothiourea Formula: C30H31N3O2S MolecularWeight: 497.65104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OC)C(=NC3=CC=C(C=C3)NC4=CC=CC=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OC)C(=NC3=CC=C(C=C3)NC4=CC=CC=C4)SC

InChI

InChI=1S/C30H31N3O2S/c1-34-28-17-9-23(10-18-28)21-33(22-24-11-19-29(35-2)20-12-24)30(36-3)32-27-15-13-26(14-16-27)31-25-7-5-4-6-8-25/h4-20,31H,21-22H2,1-3H3