3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C12H13N7O2S MolecularWeight: 319.34232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC1=NN=C(S1)NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C12H13N7O2S/c1-7-16-17-12(22-7)15-9(20)3-4-19-6-13-10-8(11(19)21)5-14-18(10)2/h5-6H,3-4H2,1-2H3,(H,15,17,20)