(1,5-dimethylpyrazol-3-yl)-[4-[4-(furan-2-yl)phenyl]sulfonylpiperidin-1-yl]methanone

Systemtic Name: (1,5-dimethylpyrazol-3-yl)-[4-[4-(furan-2-yl)phenyl]sulfonylpiperidin-1-yl]methanone Openeye Name: (1,5-dimethylpyrazol-3-yl)-[4-[4-(2-furyl)phenyl]sulfonyl-1-piperidyl]methanone CAS Name: (1,5-dimethyl-3-pyrazolyl)-[4-[4-(2-furanyl)phenyl]sulfonyl-1-piperidinyl]methanone IUPAC Name: (1,5-dimethylpyrazol-3-yl)-[4-[4-(furan-2-yl)phenyl]sulfonylpiperidin-1-yl]methanone Traditional Name: (1,5-dimethylpyrazol-3-yl)-[4-[4-(2-furyl)phenyl]sulfonylpiperidino]methanone Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C21H23N3O4S/c1-15-14-19(22-23(15)2)21(25)24-11-9-18(10-12-24)29(26,27)17-7-5-16(6-8-17)20-4-3-13-28-20/h3-8,13-14,18H,9-12H2,1-2H3