2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-[(3-cyano-6-methyl-2-pyridyl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=C(C=CC(=N3)C)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=C(C=CC(=N3)C)C#N

InChI

InChI=1S/C19H18N4O2S2/c1-4-25-14-7-8-15-16(9-14)27-19(22-15)23-17(24)12(3)26-18-13(10-20)6-5-11(2)21-18/h5-9,12H,4H2,1-3H3,(H,22,23,24)