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

Systemtic Name: methyl N'-(4-acetamidophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate hydroiodide Openeye Name: N-[4-[[[bis[(4-methoxyphenyl)methyl]amino]-methylsulfanyl-methylene]amino]phenyl]acetamide hydroiodide CAS Name: N'-(4-acetamidophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-(4-acetamidophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate hydroiodide Traditional Name: N-[4-[[[bis(p-anisyl)amino]-(methylthio)methylene]amino]phenyl]acetamide hydroiodide Formula: C26H30IN3O3S MolecularWeight: 591.50417

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N=C(N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC)SC.I

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N=C(N(CC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)OC)SC.I

InChI

InChI=1S/C26H29N3O3S.HI/c1-19(30)27-22-9-11-23(12-10-22)28-26(33-4)29(17-20-5-13-24(31-2)14-6-20)18-21-7-15-25(32-3)16-8-21;/h5-16H,17-18H2,1-4H3,(H,27,30);1H