3-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propionamide Formula: C23H19ClN2OS2 MolecularWeight: 438.99276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCSC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H19ClN2OS2/c1-15-2-11-20-21(14-15)29-23(26-20)16-3-7-18(8-4-16)25-22(27)12-13-28-19-9-5-17(24)6-10-19/h2-11,14H,12-13H2,1H3,(H,25,27)