4-[1-(1,3-benzothiazol-2-ylamino)-2-(4-fluorophenyl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-[1-(1,3-benzothiazol-2-ylamino)-2-(4-fluorophenyl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-[1-(1,3-benzothiazol-2-ylamino)-2-(4-fluorophenyl)-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-[1-(1,3-benzothiazol-2-ylamino)-2-(4-fluorophenyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-[1-(1,3-benzothiazol-2-ylamino)-2-(4-fluorophenyl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-[1-(1,3-benzothiazol-2-ylamino)-2-(4-fluorophenyl)-2-keto-ethyl]benzenesulfonamide Formula: C21H16FN3O3S2 MolecularWeight: 441.498443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(C3=CC=C(C=C3)S(=O)(=O)N)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(C3=CC=C(C=C3)S(=O)(=O)N)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O3S2/c22-15-9-5-14(6-10-15)20(26)19(13-7-11-16(12-8-13)30(23,27)28)25-21-24-17-3-1-2-4-18(17)29-21/h1-12,19H,(H,24,25)(H2,23,27,28)