N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C22H25N5O4S2 MolecularWeight: 487.595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CN2C3=CC=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CN2C3=CC=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25N5O4S2/c1-16-8-9-18(14-20(16)33(29,30)26-10-12-31-13-11-26)24-21(28)17(2)32-22-25-23-15-27(22)19-6-4-3-5-7-19/h3-9,14-15,17H,10-13H2,1-2H3,(H,24,28)