N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: 4-keto-N-(2-methyl-5-piperidinosulfonyl-phenyl)-4-(3-phenyl-2-pyrazolin-1-yl)butyramide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4S/c1-19-10-11-21(34(32,33)28-15-6-3-7-16-28)18-23(19)26-24(30)12-13-25(31)29-17-14-22(27-29)20-8-4-2-5-9-20/h2,4-5,8-11,18H,3,6-7,12-17H2,1H3,(H,26,30)