3-(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(3,6-dicyclopropyl-1-phenyl-4-pyrazolo[3,4-b]pyridinyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3,6-dicyclopropyl-1-phenylpyrazolo[3,4-b]pyridin-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)-1H-1,2,4-triazole-5-thione Formula: C23H22N6S MolecularWeight: 414.52598

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)C2=CC(=NC3=C2C(=NN3C4=CC=CC=C4)C5CC5)C6CC6

Isomeric SMILES

C=CCN1C(=NNC1=S)C2=CC(=NC3=C2C(=NN3C4=CC=CC=C4)C5CC5)C6CC6

InChI

InChI=1S/C23H22N6S/c1-2-12-28-21(25-26-23(28)30)17-13-18(14-8-9-14)24-22-19(17)20(15-10-11-15)27-29(22)16-6-4-3-5-7-16/h2-7,13-15H,1,8-12H2,(H,26,30)