N-(2,4-dimethoxyphenyl)-1-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]cyclohexane-1-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-1-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]cyclohexane-1-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-1-[[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]-(3-pyridylmethyl)amino]cyclohexanecarboxamide CAS Name: N-(2,4-dimethoxyphenyl)-1-[[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]-(3-pyridinylmethyl)amino]-1-cyclohexanecarboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-1-[[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]-(pyridin-3-ylmethyl)amino]cyclohexane-1-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-1-[[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]-(3-pyridylmethyl)amino]cyclohexanecarboxamide Formula: C32H37N5O4S MolecularWeight: 587.73228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CN=CC=C3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CN=CC=C3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5)OC

InChI

InChI=1S/C32H37N5O4S/c1-40-25-13-14-26(28(18-25)41-2)34-30(39)32(15-7-4-8-16-32)37(20-23-10-9-17-33-19-23)29(38)22-36-21-27(35-31(36)42)24-11-5-3-6-12-24/h3,5-6,9-14,17-19,27H,4,7-8,15-16,20-22H2,1-2H3,(H,34,39)(H,35,42)