N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H26N4O3S2/c1-16-19(17(2)26(24-16)18-9-5-3-6-10-18)15-23-22(27)21-20(11-14-30-21)31(28,29)25-12-7-4-8-13-25/h3,5-6,9-11,14H,4,7-8,12-13,15H2,1-2H3,(H,23,27)