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

Systemtic Name: 2-ethyl-N-[2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]butanamide Openeye Name: 2-ethyl-N-[2-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]butanamide CAS Name: 2-ethyl-N-[2-[[2-(2-fluoroanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]butanamide IUPAC Name: 2-ethyl-N-[2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]butanamide Traditional Name: 2-ethyl-N-[2-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]butyramide Formula: C21H22FN3O2S2 MolecularWeight: 431.546683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

CCC(CC)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C21H22FN3O2S2/c1-3-13(4-2)20(27)23-14-9-10-17-18(11-14)29-21(25-17)28-12-19(26)24-16-8-6-5-7-15(16)22/h5-11,13H,3-4,12H2,1-2H3,(H,23,27)(H,24,26)