N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C22H30N4O3S/c1-18-17-19(2)26(24-18)13-6-12-23-22(27)21-9-14-25(15-10-21)30(28,29)16-11-20-7-4-3-5-8-20/h3-5,7-8,11,16-17,21H,6,9-10,12-15H2,1-2H3,(H,23,27)/b16-11+