N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[4-methyl-3-[4-morpholinyl(oxo)methyl]-5-phenyl-2-thiophenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C20H21N5O3S2 MolecularWeight: 443.54244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCOCC2)NC(=O)CSC3=NC=NN3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCOCC2)NC(=O)CSC3=NC=NN3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N5O3S2/c1-13-16(19(27)25-7-9-28-10-8-25)18(30-17(13)14-5-3-2-4-6-14)23-15(26)11-29-20-21-12-22-24-20/h2-6,12H,7-11H2,1H3,(H,23,26)(H,21,22,24)