N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(3-pyridylmethyl)acetamide CAS Name: N-[4-(methylthio)-1,3-benzothiazol-2-yl]-2-phenyl-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-[4-(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=CC=CC2=C1N=C(S2)N(CC3=CN=CC=C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N(CC3=CN=CC=C3)C(=O)CC4=CC=CC=C4

InChI

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