5-chloranyl-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: 5-chloranyl-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: 5-chloro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide CAS Name: 5-chloro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: 5-chloro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: 5-chloro-N-(2-methyl-1,3-benzothiazol-5-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)nicotinamide Formula: C22H17ClN6OS MolecularWeight: 448.92798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CN=C3NCC4=C5C=CNC5=NC=C4)Cl

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CN=C3NCC4=C5C=CNC5=NC=C4)Cl

InChI

InChI=1S/C22H17ClN6OS/c1-12-28-18-9-15(2-3-19(18)31-12)29-22(30)17-8-14(23)11-27-21(17)26-10-13-4-6-24-20-16(13)5-7-25-20/h2-9,11H,10H2,1H3,(H,24,25)(H,26,27)(H,29,30)