2-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-(1H-indazol-6-yl)pyridine-3-carboxamide

Systemtic Name: 2-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-(1H-indazol-6-yl)pyridine-3-carboxamide Openeye Name: 2-[(2-acetamido-4-pyridyl)methylsulfanyl]-N-(1H-indazol-6-yl)pyridine-3-carboxamide CAS Name: 2-[(2-acetamido-4-pyridinyl)methylthio]-N-(1H-indazol-6-yl)-3-pyridinecarboxamide IUPAC Name: 2-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-(1H-indazol-6-yl)pyridine-3-carboxamide Traditional Name: 2-[(2-acetamido-4-pyridyl)methylthio]-N-(1H-indazol-6-yl)nicotinamide Formula: C21H18N6O2S MolecularWeight: 418.47162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)NC3=CC4=C(C=C3)C=NN4

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)NC3=CC4=C(C=C3)C=NN4

InChI

InChI=1S/C21H18N6O2S/c1-13(28)25-19-9-14(6-8-22-19)12-30-21-17(3-2-7-23-21)20(29)26-16-5-4-15-11-24-27-18(15)10-16/h2-11H,12H2,1H3,(H,24,27)(H,26,29)(H,22,25,28)