N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]propionamide Formula: C18H17FN2O3S2 MolecularWeight: 392.467583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)NC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)NC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN2O3S2/c1-23-13-7-8-14(24-2)17-16(13)21-18(26-17)20-15(22)9-10-25-12-5-3-11(19)4-6-12/h3-8H,9-10H2,1-2H3,(H,20,21,22)