N-(3-ethyl-2-morpholin-4-yl-pentyl)-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-(3-ethyl-2-morpholino-pentyl)-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-(3-ethyl-2-morpholin-4-ylpentyl)-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-(3-ethyl-2-morpholino-pentyl)-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1=CNC(=S)N1C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNC(=O)C1=CNC(=S)N1C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C21H30N4O2S/c1-3-16(4-2)18(24-10-12-27-13-11-24)14-22-20(26)19-15-23-21(28)25(19)17-8-6-5-7-9-17/h5-9,15-16,18H,3-4,10-14H2,1-2H3,(H,22,26)(H,23,28)