2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 2-[(3-cyano-1-pyrindan-2-yl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C)SC3=NC4=C(CCC4)C=C3C#N

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C)SC3=NC4=C(CCC4)C=C3C#N

InChI

InChI=1S/C21H20N4OS2/c1-3-17(27-20-14(11-22)10-13-5-4-6-15(13)23-20)19(26)25-21-24-16-8-7-12(2)9-18(16)28-21/h7-10,17H,3-6H2,1-2H3,(H,24,25,26)