2-[4-[[4-(indazol-1-ylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]sulfanyl]phenyl]ethanenitrile

Systemtic Name: 2-[4-[[4-(indazol-1-ylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]sulfanyl]phenyl]ethanenitrile Openeye Name: 2-[4-[[4-(indazol-1-ylamino)-6-(3-pyridyl)-1,3,5-triazin-2-yl]sulfanyl]phenyl]acetonitrile CAS Name: 2-[4-[[4-(1-indazolylamino)-6-(3-pyridinyl)-1,3,5-triazin-2-yl]thio]phenyl]acetonitrile IUPAC Name: 2-[4-[[4-(indazol-1-ylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]sulfanyl]phenyl]acetonitrile Traditional Name: 2-[4-[[4-(indazol-1-ylamino)-6-(3-pyridyl)-s-triazin-2-yl]thio]phenyl]acetonitrile Formula: C23H16N8S MolecularWeight: 436.49174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN2NC3=NC(=NC(=N3)C4=CN=CC=C4)SC5=CC=C(C=C5)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=NN2NC3=NC(=NC(=N3)C4=CN=CC=C4)SC5=CC=C(C=C5)CC#N

InChI

InChI=1S/C23H16N8S/c24-12-11-16-7-9-19(10-8-16)32-23-28-21(18-5-3-13-25-14-18)27-22(29-23)30-31-20-6-2-1-4-17(20)15-26-31/h1-10,13-15H,11H2,(H,27,28,29,30)