N-(1-phenylethyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1-phenylethyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1-phenylethyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1-phenylethyl)-1-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(1-phenylethyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-phenylethyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-isonipecotamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C20H28N4O3S/c1-14(17-8-6-5-7-9-17)21-20(25)18-10-12-24(13-11-18)28(26,27)19-15(2)22-23(4)16(19)3/h5-9,14,18H,10-13H2,1-4H3,(H,21,25)