2-chloranyl-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-5-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)Cl)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5CC5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5CC5

InChI

InChI=1S/C21H20ClN3O4S/c22-17-7-6-15(30(27,28)25-9-1-2-10-25)12-16(17)20(26)23-14-5-8-19-18(11-14)24-21(29-19)13-3-4-13/h5-8,11-13H,1-4,9-10H2,(H,23,26)