4-(furan-2-yl)-1-[(4-sulfonylcyclohexa-1,5-dien-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 4-(furan-2-yl)-1-[(4-sulfonylcyclohexa-1,5-dien-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 4-(2-furyl)-1-[(4-sulfonylcyclohexa-1,5-dien-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 4-(2-furanyl)-1-[(4-sulfonyl-1-cyclohexa-1,5-dienyl)methyl]-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 4-(furan-2-yl)-1-[(4-sulfonylcyclohexa-1,5-dien-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: [4-(2-furyl)-1-[(4-sulfonylcyclohexa-1,5-dien-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1=S(=O)=O)CN2C3=NC(=NC(=C3C=N2)C4=CC=CO4)N

Isomeric SMILES

C1C=C(C=CC1=S(=O)=O)CN2C3=NC(=NC(=C3C=N2)C4=CC=CO4)N

InChI

InChI=1S/C16H13N5O3S/c17-16-19-14(13-2-1-7-24-13)12-8-18-21(15(12)20-16)9-10-3-5-11(6-4-10)25(22)23/h1-5,7-8H,6,9H2,(H2,17,19,20)