3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: 3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: 3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-morpholinophenyl)propanamide CAS Name: 3-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: 3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-(4-morpholinophenyl)propionamide Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCCC(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCCC(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C19H22N6O2S/c1-24-18-16(12-22-24)19(21-13-20-18)28-11-6-17(26)23-14-2-4-15(5-3-14)25-7-9-27-10-8-25/h2-5,12-13H,6-11H2,1H3,(H,23,26)