2-methyl-5-nitro-N-[4-(5-thiophen-2-yl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[4-(5-thiophen-2-yl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[4-[5-(2-thienyl)-4,5-dihydroisoxazol-3-yl]phenyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[4-(5-thiophen-2-yl-4,5-dihydroisoxazol-3-yl)phenyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[4-(5-thiophen-2-yl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[4-[5-(2-thienyl)-2-isoxazolin-3-yl]phenyl]benzenesulfonamide Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)C3=NOC(C3)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)C3=NOC(C3)C4=CC=CS4

InChI

InChI=1S/C20H17N3O5S2/c1-13-4-9-16(23(24)25)11-20(13)30(26,27)22-15-7-5-14(6-8-15)17-12-18(28-21-17)19-3-2-10-29-19/h2-11,18,22H,12H2,1H3