1-[3,5-dimethyl-1-[3-(3-methylphenoxy)propyl]pyrazol-4-yl]sulfonylpiperidine

Systemtic Name: 1-[3,5-dimethyl-1-[3-(3-methylphenoxy)propyl]pyrazol-4-yl]sulfonylpiperidine Openeye Name: 1-[3,5-dimethyl-1-[3-(3-methylphenoxy)propyl]pyrazol-4-yl]sulfonylpiperidine CAS Name: 1-[[3,5-dimethyl-1-[3-(3-methylphenoxy)propyl]-4-pyrazolyl]sulfonyl]piperidine IUPAC Name: 1-[3,5-dimethyl-1-[3-(3-methylphenoxy)propyl]pyrazol-4-yl]sulfonylpiperidine Traditional Name: 1-[3,5-dimethyl-1-[3-(3-methylphenoxy)propyl]pyrazol-4-yl]sulfonylpiperidine Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCN2C(=C(C(=N2)C)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCN2C(=C(C(=N2)C)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C20H29N3O3S/c1-16-9-7-10-19(15-16)26-14-8-13-23-18(3)20(17(2)21-23)27(24,25)22-11-5-4-6-12-22/h7,9-10,15H,4-6,8,11-14H2,1-3H3