4-butoxy-N-[2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-butoxy-N-[2-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-butoxy-N-[2-[[2-(2-fluoroanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-butoxy-N-[2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-butoxy-N-[2-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C26H24FN3O3S2 MolecularWeight: 509.615463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C26H24FN3O3S2/c1-2-3-14-33-19-11-8-17(9-12-19)25(32)28-18-10-13-22-23(15-18)35-26(30-22)34-16-24(31)29-21-7-5-4-6-20(21)27/h4-13,15H,2-3,14,16H2,1H3,(H,28,32)(H,29,31)