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

Systemtic Name: N-[[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[[5-(4-chlorophenyl)isoxazol-3-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[[5-(4-chlorophenyl)-3-isoxazolyl]methyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[[5-(4-chlorophenyl)isoxazol-3-yl]methyl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NOC(=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NOC(=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN3O4S/c22-17-7-3-15(4-8-17)20-13-18(24-29-20)14-23-21(26)16-5-9-19(10-6-16)30(27,28)25-11-1-2-12-25/h3-10,13H,1-2,11-12,14H2,(H,23,26)