N-(1,3-benzodioxol-5-yl)-1-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-[(5-methylisoxazol-3-yl)methylsulfanyl]benzoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[2-[(5-methyl-3-isoxazolyl)methylthio]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]benzoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-[(5-methylisoxazol-3-yl)methylthio]benzoyl]isonipecotamide Formula: C25H25N3O5S MolecularWeight: 479.5481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H25N3O5S/c1-16-12-19(27-33-16)14-34-23-5-3-2-4-20(23)25(30)28-10-8-17(9-11-28)24(29)26-18-6-7-21-22(13-18)32-15-31-21/h2-7,12-13,17H,8-11,14-15H2,1H3,(H,26,29)