ethyl N'-(2-chloranyl-5-methoxy-phenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate

Systemtic Name: ethyl N'-(2-chloranyl-5-methoxy-phenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 3-(2-chloro-5-methoxy-phenyl)-2-ethyl-1,1-bis[(4-methoxyphenyl)methyl]isothiourea CAS Name: N'-(2-chloro-5-methoxyphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-(2-chloro-5-methoxyphenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 3-(2-chloro-5-methoxy-phenyl)-2-ethyl-1,1-bis(p-anisyl)isothiourea Formula: C26H29ClN2O3S MolecularWeight: 485.03806

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=C(C=CC(=C1)OC)Cl)N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCSC(=NC1=C(C=CC(=C1)OC)Cl)N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H29ClN2O3S/c1-5-33-26(28-25-16-23(32-4)14-15-24(25)27)29(17-19-6-10-21(30-2)11-7-19)18-20-8-12-22(31-3)13-9-20/h6-16H,5,17-18H2,1-4H3