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

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H28N4O3S2/c1-17-20(18(2)27(25-17)16-19-9-5-3-6-10-19)15-24-23(28)22-21(11-14-31-22)32(29,30)26-12-7-4-8-13-26/h3,5-6,9-11,14H,4,7-8,12-13,15-16H2,1-2H3,(H,24,28)