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

Systemtic Name: 3-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(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)CCSC3=C(C=CC(=N3)C)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=C(C=CC(=N3)C)C#N

InChI

InChI=1S/C19H18N4O2S2/c1-3-25-14-6-7-15-16(10-14)27-19(22-15)23-17(24)8-9-26-18-13(11-20)5-4-12(2)21-18/h4-7,10H,3,8-9H2,1-2H3,(H,22,23,24)