6-[(1-ethylpyrrolidin-2-yl)methylamino]-3-methylsulfanyl-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(1-ethylpyrrolidin-2-yl)methylamino]-3-methylsulfanyl-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(1-ethylpyrrolidin-2-yl)methylamino]-3-methylsulfanyl-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(1-ethyl-2-pyrrolidinyl)methylamino]-3-(methylthio)-1,5-diphenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-[(1-ethylpyrrolidin-2-yl)methylamino]-3-methylsulfanyl-1,5-diphenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(1-ethylpyrrolidin-2-yl)methylamino]-3-(methylthio)-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H28N6OS MolecularWeight: 460.59442

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC2=NC3=C(C(=NN3C4=CC=CC=C4)SC)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

CCN1CCCC1CNC2=NC3=C(C(=NN3C4=CC=CC=C4)SC)C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C25H28N6OS/c1-3-29-16-10-15-20(29)17-26-25-27-22-21(24(32)30(25)18-11-6-4-7-12-18)23(33-2)28-31(22)19-13-8-5-9-14-19/h4-9,11-14,20H,3,10,15-17H2,1-2H3,(H,26,27)