5-(4-chlorophenyl)-N-(3-piperidin-1-ylsulfonylphenyl)-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-(3-piperidin-1-ylsulfonylphenyl)-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[3-(1-piperidylsulfonyl)phenyl]-1H-pyrazole-4-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[3-(1-piperidinylsulfonyl)phenyl]-1H-pyrazole-4-carboxamide IUPAC Name: 5-(4-chlorophenyl)-N-(3-piperidin-1-ylsulfonylphenyl)-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-(3-piperidinosulfonylphenyl)-1H-pyrazole-4-carboxamide Formula: C21H21ClN4O3S MolecularWeight: 444.93444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O3S/c22-16-9-7-15(8-10-16)20-19(14-23-25-20)21(27)24-17-5-4-6-18(13-17)30(28,29)26-11-2-1-3-12-26/h4-10,13-14H,1-3,11-12H2,(H,23,25)(H,24,27)