N'-(5-chloranyl-2-cyano-pyrimidin-4-yl)-N'-(2-methylpropyl)-4-(pyrrolidin-1-ylmethyl)benzohydrazide

Systemtic Name: N'-(5-chloranyl-2-cyano-pyrimidin-4-yl)-N'-(2-methylpropyl)-4-(pyrrolidin-1-ylmethyl)benzohydrazide Openeye Name: N'-(5-chloro-2-cyano-pyrimidin-4-yl)-N'-isobutyl-4-(pyrrolidin-1-ylmethyl)benzohydrazide CAS Name: N'-(5-chloro-2-cyano-4-pyrimidinyl)-N'-(2-methylpropyl)-4-(1-pyrrolidinylmethyl)benzohydrazide IUPAC Name: N'-(5-chloro-2-cyanopyrimidin-4-yl)-N'-(2-methylpropyl)-4-(pyrrolidin-1-ylmethyl)benzohydrazide Traditional Name: N'-(5-chloro-2-cyano-pyrimidin-4-yl)-N'-isobutyl-4-(pyrrolidinomethyl)benzohydrazide Formula: C21H25ClN6O MolecularWeight: 412.9158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=NC(=NC=C1Cl)C#N)NC(=O)C2=CC=C(C=C2)CN3CCCC3

Isomeric SMILES

CC(C)CN(C1=NC(=NC=C1Cl)C#N)NC(=O)C2=CC=C(C=C2)CN3CCCC3

InChI

InChI=1S/C21H25ClN6O/c1-15(2)13-28(20-18(22)12-24-19(11-23)25-20)26-21(29)17-7-5-16(6-8-17)14-27-9-3-4-10-27/h5-8,12,15H,3-4,9-10,13-14H2,1-2H3,(H,26,29)