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

Systemtic Name: 3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: 3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C16H21N7O2S MolecularWeight: 375.44864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C16H21N7O2S/c1-4-10(5-2)14-20-21-16(26-14)19-12(24)6-7-23-9-17-13-11(15(23)25)8-18-22(13)3/h8-10H,4-7H2,1-3H3,(H,19,21,24)