N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]octanamide

Systemtic Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]octanamide Openeye Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-furyl]methyleneamino]octanamide CAS Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-2-furanyl]methylideneamino]octanamide IUPAC Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]octanamide Traditional Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-2-furyl]methyleneamino]caprylamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NN=CC1=CC=C(O1)SC2=NC3=C(S2)C=C(C=C3)OCC

Isomeric SMILES

CCCCCCCC(=O)N/N=C/C1=CC=C(O1)SC2=NC3=C(S2)C=C(C=C3)OCC

InChI

InChI=1S/C22H27N3O3S2/c1-3-5-6-7-8-9-20(26)25-23-15-17-11-13-21(28-17)30-22-24-18-12-10-16(27-4-2)14-19(18)29-22/h10-15H,3-9H2,1-2H3,(H,25,26)/b23-15+