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

Systemtic Name: 3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide Openeye Name: 3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide CAS Name: 3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-[2-(4-methylphenoxy)ethyl]propanamide IUPAC Name: 3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide Traditional Name: 3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[2-(4-methylphenoxy)ethyl]propionamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)CCN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)CCN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C18H21N5O3/c1-13-3-5-14(6-4-13)26-10-8-19-16(24)7-9-23-12-20-17-15(18(23)25)11-21-22(17)2/h3-6,11-12H,7-10H2,1-2H3,(H,19,24)