N-(4-methyl-2-morpholin-4-yl-pentyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(4-methyl-2-morpholin-4-yl-pentyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(4-methyl-2-morpholino-pentyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[4-methyl-2-(4-morpholinyl)pentyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(4-methyl-2-morpholino-pentyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H29N5O2S2 MolecularWeight: 423.59586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2)N3CCOCC3

Isomeric SMILES

CC(C)CC(CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2)N3CCOCC3

InChI

InChI=1S/C19H29N5O2S2/c1-14(2)12-15(23-7-9-26-10-8-23)13-20-17(25)5-6-24-18(21-22-19(24)27)16-4-3-11-28-16/h3-4,11,14-15H,5-10,12-13H2,1-2H3,(H,20,25)(H,22,27)