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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C18H18N6O2S MolecularWeight: 382.43952

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)CCN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)CCN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C18H18N6O2S/c1-3-24(18-21-13-6-4-5-7-14(13)27-18)15(25)8-9-23-11-19-16-12(17(23)26)10-20-22(16)2/h4-7,10-11H,3,8-9H2,1-2H3