N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=C(N(N=C2C)C)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=C(N(N=C2C)C)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H30N4O3S/c1-15-8-9-18(14-20(15)29(27,28)25-12-6-5-7-13-25)22-21(26)11-10-19-16(2)23-24(4)17(19)3/h8-9,14H,5-7,10-13H2,1-4H3,(H,22,26)