2-(4-chlorophenyl)sulfanyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C22H18ClN3O2S2 MolecularWeight: 455.98022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O2S2/c1-28-17-7-10-20-19(12-17)25-22(30-20)26(13-16-4-2-3-11-24-16)21(27)14-29-18-8-5-15(23)6-9-18/h2-12H,13-14H2,1H3