1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(2-phenylsulfanylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(2-phenylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(2-phenylsulfanylphenyl)piperidine-3-carboxamide CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-[2-(phenylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(2-phenylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-[2-(phenylthio)phenyl]nipecotamide Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O4S2/c1-16-22(17(2)30-25-16)32(28,29)26-14-8-9-18(15-26)23(27)24-20-12-6-7-13-21(20)31-19-10-4-3-5-11-19/h3-7,10-13,18H,8-9,14-15H2,1-2H3,(H,24,27)