N-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-[[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-2-keto-3-methyl-1,3-benzoxazole-6-sulfonamide Formula: C21H20FN3O4S MolecularWeight: 429.464603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)CNS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)CNS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

InChI

InChI=1S/C21H20FN3O4S/c1-13-10-15(14(2)25(13)17-6-4-16(22)5-7-17)12-23-30(27,28)18-8-9-19-20(11-18)29-21(26)24(19)3/h4-11,23H,12H2,1-3H3