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

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-[4-(dimethylamino)benzyl]-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-isonipecotamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H28N4O4S/c1-14-19(15(2)28-22-14)29(26,27)24-11-9-17(10-12-24)20(25)21-13-16-5-7-18(8-6-16)23(3)4/h5-8,17H,9-13H2,1-4H3,(H,21,25)