methyl N'-(2,6-diethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate

Systemtic Name: methyl N'-(2,6-diethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 3-(2,6-diethylphenyl)-1,1-bis[(4-methoxyphenyl)methyl]-2-methyl-isothiourea CAS Name: N'-(2,6-diethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2,6-diethylphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 3-(2,6-diethylphenyl)-2-methyl-1,1-bis(p-anisyl)isothiourea Formula: C28H34N2O2S MolecularWeight: 462.64676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N=C(N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC)SC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N=C(N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC)SC

InChI

InChI=1S/C28H34N2O2S/c1-6-23-9-8-10-24(7-2)27(23)29-28(33-5)30(19-21-11-15-25(31-3)16-12-21)20-22-13-17-26(32-4)18-14-22/h8-18H,6-7,19-20H2,1-5H3