N-(4-dimethylaminophenyl)-4-[(phenylmethyl)-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]thiane-4-carboxamide

Systemtic Name: N-(4-dimethylaminophenyl)-4-[(phenylmethyl)-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]thiane-4-carboxamide Openeye Name: 4-[benzyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)tetrahydrothiopyran-4-carboxamide CAS Name: N-(4-dimethylaminophenyl)-4-[[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]-(phenylmethyl)amino]-4-thianecarboxamide IUPAC Name: 4-[benzyl-[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)thiane-4-carboxamide Traditional Name: 4-[benzyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)tetrahydrothiopyran-4-carboxamide Formula: C32H37N5O2S2 MolecularWeight: 587.79848

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)C2(CCSCC2)N(CC3=CC=CC=C3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)C2(CCSCC2)N(CC3=CC=CC=C3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

InChI

InChI=1S/C32H37N5O2S2/c1-35(2)27-15-13-26(14-16-27)33-30(39)32(17-19-41-20-18-32)37(21-24-9-5-3-6-10-24)29(38)23-36-22-28(34-31(36)40)25-11-7-4-8-12-25/h3-16,28H,17-23H2,1-2H3,(H,33,39)(H,34,40)