2-bromanyl-3-(5-isocyano-6-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile

Systemtic Name: 2-bromanyl-3-(5-isocyano-6-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile Openeye Name: 2-bromo-3-[5-isocyano-6-(2-thienyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile CAS Name: 2-bromo-3-(5-isocyano-6-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile IUPAC Name: 2-bromo-3-(5-isocyano-6-thiophen-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Traditional Name: 2-bromo-3-[5-isocyano-6-(2-thienyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile Formula: C18H10BrN5S MolecularWeight: 408.2745

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(N=C2C(=CNN2)C1C3=CC=CC(=C3Br)C#N)C4=CC=CS4

Isomeric SMILES

[C-]#[N+]C1=C(N=C2C(=CNN2)C1C3=CC=CC(=C3Br)C#N)C4=CC=CS4

InChI

InChI=1S/C18H10BrN5S/c1-21-17-14(11-5-2-4-10(8-20)15(11)19)12-9-22-24-18(12)23-16(17)13-6-3-7-25-13/h2-7,9,14H,(H2,22,23,24)