N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-keto-3-methyl-1,3-benzoxazole-6-sulfonamide Formula: C18H18ClN3O6S2 MolecularWeight: 471.93502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4)OC1=O

InChI

InChI=1S/C18H18ClN3O6S2/c1-21-15-7-5-13(11-16(15)28-18(21)23)29(24,25)20-12-4-6-14(19)17(10-12)30(26,27)22-8-2-3-9-22/h4-7,10-11,20H,2-3,8-9H2,1H3