2-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-1-thiophen-2-yl-ethanone Openeye Name: 2-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-1-(2-thienyl)ethanone CAS Name: 2-[[1-(3,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-1-thiophen-2-ylethanone IUPAC Name: 2-[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-1-thiophen-2-ylethanone Traditional Name: 2-[[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]-1-(2-thienyl)ethanone Formula: C19H16N4OS2 MolecularWeight: 380.48654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)C4=CC=CS4)C

InChI

InChI=1S/C19H16N4OS2/c1-12-5-6-14(8-13(12)2)23-18-15(9-22-23)19(21-11-20-18)26-10-16(24)17-4-3-7-25-17/h3-9,11H,10H2,1-2H3