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

Systemtic Name: N-[[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[5-(4-chlorophenyl)isoxazol-3-yl]methyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[[5-(4-chlorophenyl)-3-isoxazolyl]methyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[[5-(4-chlorophenyl)isoxazol-3-yl]methyl]-4-piperidinosulfonyl-benzamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NOC(=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NOC(=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O4S/c23-18-8-4-16(5-9-18)21-14-19(25-30-21)15-24-22(27)17-6-10-20(11-7-17)31(28,29)26-12-2-1-3-13-26/h4-11,14H,1-3,12-13,15H2,(H,24,27)