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

Systemtic Name: N-[4-(cyanomethyl)phenyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-isonipecotamide Formula: C19H22N4O4S MolecularWeight: 402.46738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C19H22N4O4S/c1-13-18(14(2)27-22-13)28(25,26)23-11-8-16(9-12-23)19(24)21-17-5-3-15(4-6-17)7-10-20/h3-6,16H,7-9,11-12H2,1-2H3,(H,21,24)