(2S)-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]-N-(3-methylphenyl)propanamide

Systemtic Name: (2S)-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]-N-(3-methylphenyl)propanamide Openeye Name: (2S)-2-[3,5-dimethyl-4-[(4-methyl-1-piperidyl)sulfonyl]pyrazol-1-yl]-N-(m-tolyl)propanamide CAS Name: (2S)-2-[3,5-dimethyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-1-pyrazolyl]-N-(3-methylphenyl)propanamide IUPAC Name: (2S)-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonylpyrazol-1-yl]-N-(3-methylphenyl)propanamide Traditional Name: (2S)-2-[3,5-dimethyl-4-(4-methylpiperidino)sulfonyl-pyrazol-1-yl]-N-(m-tolyl)propionamide Formula: C21H30N4O3S MolecularWeight: 418.5529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C(C)C(=O)NC3=CC=CC(=C3)C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)[C@@H](C)C(=O)NC3=CC=CC(=C3)C)C

InChI

InChI=1S/C21H30N4O3S/c1-14-9-11-24(12-10-14)29(27,28)20-16(3)23-25(17(20)4)18(5)21(26)22-19-8-6-7-15(2)13-19/h6-8,13-14,18H,9-12H2,1-5H3,(H,22,26)/t18-/m0/s1