N-(3,4-dimethoxyphenyl)-2-[(5-naphthalen-1-yl-4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[(5-naphthalen-1-yl-4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[[5-(1-naphthyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[5-(1-naphthalenyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[(5-naphthalen-1-yl-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[4-keto-5-(1-naphthyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide Formula: C25H21N5O4S MolecularWeight: 487.53034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=CC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=CC5=CC=CC=C54)OC

InChI

InChI=1S/C25H21N5O4S/c1-33-20-11-10-16(12-21(20)34-2)27-22(31)14-35-25-28-23-18(13-26-29-23)24(32)30(25)19-9-5-7-15-6-3-4-8-17(15)19/h3-13H,14H2,1-2H3,(H,26,29)(H,27,31)