5-methyl-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-methyl-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-methyl-N-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]isoxazole-3-carboxamide CAS Name: 5-methyl-N-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]-3-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-methyl-N-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]isoxazole-3-carboxamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NOC(=C3)C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NOC(=C3)C

InChI

InChI=1S/C17H21N3O4S/c1-12-4-3-9-20(11-12)25(22,23)15-7-5-14(6-8-15)18-17(21)16-10-13(2)24-19-16/h5-8,10,12H,3-4,9,11H2,1-2H3,(H,18,21)/t12-/m0/s1