3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(3-cyano-5,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)propionamide Formula: C21H20N6OS MolecularWeight: 404.4881

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=C(N4C(=C(C=N4)C#N)N=C3C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=C(N4C(=C(C=N4)C#N)N=C3C)C

InChI

InChI=1S/C21H20N6OS/c1-4-14-5-7-17-18(9-14)29-21(25-17)26-19(28)8-6-16-12(2)24-20-15(10-22)11-23-27(20)13(16)3/h5,7,9,11H,4,6,8H2,1-3H3,(H,25,26,28)