N-[[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[5-(3-methoxyphenyl)isoxazol-3-yl]methyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[[5-(3-methoxyphenyl)-3-isoxazolyl]methyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[[5-(3-methoxyphenyl)isoxazol-3-yl]methyl]-4-piperidinosulfonyl-benzamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=NO2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=NO2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H25N3O5S/c1-30-20-7-5-6-18(14-20)22-15-19(25-31-22)16-24-23(27)17-8-10-21(11-9-17)32(28,29)26-12-3-2-4-13-26/h5-11,14-15H,2-4,12-13,16H2,1H3,(H,24,27)