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

Systemtic Name: 4-[cyclopropyl-[2-(4-phenyl-2-sulfanylidene-imidazolidin-1-yl)ethanoyl]amino]-N-(4-morpholin-4-ylphenyl)thiane-4-carboxamide Openeye Name: 4-[cyclopropyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-morpholinophenyl)tetrahydrothiopyran-4-carboxamide CAS Name: 4-[cyclopropyl-[1-oxo-2-(4-phenyl-2-sulfanylidene-1-imidazolidinyl)ethyl]amino]-N-[4-(4-morpholinyl)phenyl]-4-thianecarboxamide IUPAC Name: 4-[cyclopropyl-[2-(4-phenyl-2-sulfanylideneimidazolidin-1-yl)acetyl]amino]-N-(4-morpholin-4-ylphenyl)thiane-4-carboxamide Traditional Name: 4-[cyclopropyl-[2-(4-phenyl-2-thioxo-imidazolidin-1-yl)acetyl]amino]-N-(4-morpholinophenyl)tetrahydrothiopyran-4-carboxamide Formula: C30H37N5O3S2 MolecularWeight: 579.77648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(=O)CN2CC(NC2=S)C3=CC=CC=C3)C4(CCSCC4)C(=O)NC5=CC=C(C=C5)N6CCOCC6

Isomeric SMILES

C1CC1N(C(=O)CN2CC(NC2=S)C3=CC=CC=C3)C4(CCSCC4)C(=O)NC5=CC=C(C=C5)N6CCOCC6

InChI

InChI=1S/C30H37N5O3S2/c36-27(21-34-20-26(32-29(34)39)22-4-2-1-3-5-22)35(25-10-11-25)30(12-18-40-19-13-30)28(37)31-23-6-8-24(9-7-23)33-14-16-38-17-15-33/h1-9,25-26H,10-21H2,(H,31,37)(H,32,39)