1-methyl-N'-[3-(pyrimidin-2-ylamino)phenyl]carbonyl-indole-3-carbohydrazide

Systemtic Name: 1-methyl-N'-[3-(pyrimidin-2-ylamino)phenyl]carbonyl-indole-3-carbohydrazide Openeye Name: 1-methyl-N'-[3-(pyrimidin-2-ylamino)benzoyl]indole-3-carbohydrazide CAS Name: 1-methyl-N'-[oxo-[3-(2-pyrimidinylamino)phenyl]methyl]-3-indolecarbohydrazide IUPAC Name: 1-methyl-N'-[3-(pyrimidin-2-ylamino)benzoyl]indole-3-carbohydrazide Traditional Name: 1-methyl-N'-[3-(2-pyrimidylamino)benzoyl]indole-3-carbohydrazide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C21H18N6O2/c1-27-13-17(16-8-2-3-9-18(16)27)20(29)26-25-19(28)14-6-4-7-15(12-14)24-21-22-10-5-11-23-21/h2-13H,1H3,(H,25,28)(H,26,29)(H,22,23,24)