3-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)C

InChI

InChI=1S/C20H20N4O2S2/c1-11-12(2)15(10-21)19(22-13(11)3)27-8-7-18(25)24-20-23-16-6-5-14(26-4)9-17(16)28-20/h5-6,9H,7-8H2,1-4H3,(H,23,24,25)