3-(4-chlorophenyl)sulfanyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)propionamide Formula: C24H22ClN3OS2 MolecularWeight: 468.03398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H22ClN3OS2/c1-2-17-6-11-21-22(15-17)31-24(27-21)28(16-19-5-3-4-13-26-19)23(29)12-14-30-20-9-7-18(25)8-10-20/h3-11,13,15H,2,12,14,16H2,1H3