N-(4-morpholin-4-ylphenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-morpholinophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-morpholinophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H21N5O2S2/c1-13(28-19-21-17(22-23-19)16-3-2-12-27-16)18(25)20-14-4-6-15(7-5-14)24-8-10-26-11-9-24/h2-7,12-13H,8-11H2,1H3,(H,20,25)(H,21,22,23)