2,5-dimethyl-1-phenyl-N'-[4-(pyrimidin-2-ylamino)butanoyl]pyrrole-3-carbohydrazide

Systemtic Name: 2,5-dimethyl-1-phenyl-N'-[4-(pyrimidin-2-ylamino)butanoyl]pyrrole-3-carbohydrazide Openeye Name: 2,5-dimethyl-1-phenyl-N'-[4-(pyrimidin-2-ylamino)butanoyl]pyrrole-3-carbohydrazide CAS Name: 2,5-dimethyl-N'-[1-oxo-4-(2-pyrimidinylamino)butyl]-1-phenyl-3-pyrrolecarbohydrazide IUPAC Name: 2,5-dimethyl-1-phenyl-N'-[4-(pyrimidin-2-ylamino)butanoyl]pyrrole-3-carbohydrazide Traditional Name: 2,5-dimethyl-1-phenyl-N'-[4-(2-pyrimidylamino)butanoyl]pyrrole-3-carbohydrazide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNC(=O)CCCNC3=NC=CC=N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNC(=O)CCCNC3=NC=CC=N3

InChI

InChI=1S/C21H24N6O2/c1-15-14-18(16(2)27(15)17-8-4-3-5-9-17)20(29)26-25-19(28)10-6-11-22-21-23-12-7-13-24-21/h3-5,7-9,12-14H,6,10-11H2,1-2H3,(H,25,28)(H,26,29)(H,22,23,24)