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

Systemtic Name: 4-[cyclopropyl-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]-N-(4-dimethylaminophenyl)thiane-4-carboxamide Openeye Name: 4-[cyclopropyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)tetrahydrothiopyran-4-carboxamide CAS Name: 4-[cyclopropyl-[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]amino]-N-(4-dimethylaminophenyl)-4-thianecarboxamide IUPAC Name: 4-[cyclopropyl-[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)thiane-4-carboxamide Traditional Name: 4-[cyclopropyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-dimethylaminophenyl)tetrahydrothiopyran-4-carboxamide Formula: C28H35N5O2S2 MolecularWeight: 537.7398

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)C2(CCSCC2)N(C3CC3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)C2(CCSCC2)N(C3CC3)C(=O)CN4CC(NC4=S)C5=CC=CC=C5

InChI

InChI=1S/C28H35N5O2S2/c1-31(2)22-10-8-21(9-11-22)29-26(35)28(14-16-37-17-15-28)33(23-12-13-23)25(34)19-32-18-24(30-27(32)36)20-6-4-3-5-7-20/h3-11,23-24H,12-19H2,1-2H3,(H,29,35)(H,30,36)