N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-[(1-morpholinocyclohexyl)methyl]-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[[1-(4-morpholinyl)cyclohexyl]methyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-[(1-morpholinocyclohexyl)methyl]-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CNC(=S)N2C3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CNC(=S)N2C3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H28N4O2S/c26-19(18-15-22-20(28)25(18)17-7-3-1-4-8-17)23-16-21(9-5-2-6-10-21)24-11-13-27-14-12-24/h1,3-4,7-8,15H,2,5-6,9-14,16H2,(H,22,28)(H,23,26)