N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanamide

Systemtic Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanamide Openeye Name: N-[2-(dimethylamino)-5-(1-piperidylsulfonyl)phenyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetamide CAS Name: N-[2-(dimethylamino)-5-(1-piperidinylsulfonyl)phenyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetamide IUPAC Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonylphenyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetamide Traditional Name: N-[2-(dimethylamino)-5-piperidinosulfonyl-phenyl]-2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetamide Formula: C21H30N4O4S2 MolecularWeight: 466.6173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N(C)C

InChI

InChI=1S/C21H30N4O4S2/c1-15-18(16(2)29-23-15)13-30-14-21(26)22-19-12-17(8-9-20(19)24(3)4)31(27,28)25-10-6-5-7-11-25/h8-9,12H,5-7,10-11,13-14H2,1-4H3,(H,22,26)