N-[(5-chloranylthiophen-2-yl)methyl]-N-methyl-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-N-methyl-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-3-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-methyl-propionamide Formula: C20H18ClN5O2S MolecularWeight: 427.90722

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H18ClN5O2S/c1-25(12-14-7-8-16(21)29-14)18(27)10-9-17-23-19-15(20(28)24-17)11-22-26(19)13-5-3-2-4-6-13/h2-8,11,22H,9-10,12H2,1H3