methyl 3-[[[bis[(4-methoxyphenyl)methyl]amino]-ethylsulfanyl-methylidene]amino]benzoate hydroiodide

Systemtic Name: methyl 3-[[[bis[(4-methoxyphenyl)methyl]amino]-ethylsulfanyl-methylidene]amino]benzoate hydroiodide Openeye Name: methyl 3-[[[bis[(4-methoxyphenyl)methyl]amino]-ethylsulfanyl-methylene]amino]benzoate hydroiodide CAS Name: 3-[[[bis[(4-methoxyphenyl)methyl]amino]-(ethylthio)methylidene]amino]benzoic acid methyl ester hydroiodide IUPAC Name: methyl 3-[[[bis[(4-methoxyphenyl)methyl]amino]-ethylsulfanylmethylidene]amino]benzoate hydroiodide Traditional Name: 3-[[[bis(p-anisyl)amino]-(ethylthio)methylene]amino]benzoic acid methyl ester hydroiodide Formula: C27H31IN2O4S MolecularWeight: 606.51551

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N2O4S.HI/c1-5-34-27(28-23-8-6-7-22(17-23)26(30)33-4)29(18-20-9-13-24(31-2)14-10-20)19-21-11-15-25(32-3)16-12-21;/h6-17H,5,18-19H2,1-4H3;1H