N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]propionamide Formula: C18H17FN2OS2 MolecularWeight: 360.468783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)NC(=O)CCSC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)NC(=O)CCSC3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H17FN2OS2/c1-11-9-12(2)17-15(10-11)20-18(24-17)21-16(22)7-8-23-14-5-3-13(19)4-6-14/h3-6,9-10H,7-8H2,1-2H3,(H,20,21,22)