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

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: 4-keto-N-(4-methoxy-3-piperidinosulfonyl-phenyl)-4-(3-phenyl-2-pyrazolin-1-yl)butyramide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H30N4O5S/c1-34-22-11-10-20(18-23(22)35(32,33)28-15-6-3-7-16-28)26-24(30)12-13-25(31)29-17-14-21(27-29)19-8-4-2-5-9-19/h2,4-5,8-11,18H,3,6-7,12-17H2,1H3,(H,26,30)