(3S)-1-methylsulfonyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-methylsulfonyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]piperidine-3-carboxamide Openeye Name: (3S)-1-methylsulfonyl-N-[1-(1-naphthylmethyl)pyrazol-3-yl]piperidine-3-carboxamide CAS Name: (3S)-1-methylsulfonyl-N-[1-(1-naphthalenylmethyl)-3-pyrazolyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-methylsulfonyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]piperidine-3-carboxamide Traditional Name: (3S)-1-mesyl-N-[1-(1-naphthylmethyl)pyrazol-3-yl]nipecotamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C(=O)NC2=NN(C=C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)N1CCC[C@@H](C1)C(=O)NC2=NN(C=C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H24N4O3S/c1-29(27,28)25-12-5-9-18(15-25)21(26)22-20-11-13-24(23-20)14-17-8-4-7-16-6-2-3-10-19(16)17/h2-4,6-8,10-11,13,18H,5,9,12,14-15H2,1H3,(H,22,23,26)/t18-/m0/s1