N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(3-pyridylmethyl)acetamide CAS Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-2-phenyl-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-2-phenyl-N-(3-pyridylmethyl)acetamide Formula: C22H19N3OS2 MolecularWeight: 405.53576

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)N(CC3=CN=CC=C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)N(CC3=CN=CC=C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H19N3OS2/c1-27-18-9-10-19-20(13-18)28-22(24-19)25(15-17-8-5-11-23-14-17)21(26)12-16-6-3-2-4-7-16/h2-11,13-14H,12,15H2,1H3