N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-(1,3,4-thiadiazol-2-ylthio)propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(1,3,4-thiadiazol-2-ylthio)propionamide Formula: C16H20N4O4S3 MolecularWeight: 428.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CS2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CS2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H20N4O4S3/c1-11-3-4-13(18-15(21)12(2)26-16-19-17-10-25-16)9-14(11)27(22,23)20-5-7-24-8-6-20/h3-4,9-10,12H,5-8H2,1-2H3,(H,18,21)