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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(4-methyl-3-piperidinosulfonyl-phenyl)benzamide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=C(ON=C3C)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=C(ON=C3C)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H29N3O4S2/c1-17-11-12-20(15-24(17)34(30,31)28-13-7-4-8-14-28)26-25(29)21-9-5-6-10-23(21)33-16-22-18(2)27-32-19(22)3/h5-6,9-12,15H,4,7-8,13-14,16H2,1-3H3,(H,26,29)