3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(1-ethylsulfonylpiperidin-4-yl)propanamide

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(1-ethylsulfonylpiperidin-4-yl)propanamide Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(1-ethylsulfonyl-4-piperidyl)propanamide CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(1-ethylsulfonyl-4-piperidinyl)propanamide IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(1-ethylsulfonylpiperidin-4-yl)propanamide Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(1-esyl-4-piperidyl)propionamide Formula: C21H30N4O3S MolecularWeight: 418.5529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)NC(=O)CCC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)NC(=O)CCC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H30N4O3S/c1-4-29(27,28)24-14-12-18(13-15-24)22-21(26)11-10-20-16(2)23-25(17(20)3)19-8-6-5-7-9-19/h5-9,18H,4,10-15H2,1-3H3,(H,22,26)