(2S)-N'-(4-chlorophenyl)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carbohydrazide

Systemtic Name: (2S)-N'-(4-chlorophenyl)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carbohydrazide Openeye Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N'-(4-chlorophenyl)pyrrolidine-2-carbohydrazide CAS Name: (2S)-1-(4-anilino-2-pyrimidinyl)-N'-(4-chlorophenyl)-2-pyrrolidinecarbohydrazide IUPAC Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N'-(4-chlorophenyl)pyrrolidine-2-carbohydrazide Traditional Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N'-(4-chlorophenyl)pyrrolidine-2-carbohydrazide Formula: C21H21ClN6O MolecularWeight: 408.88404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NNC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[C@H](N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NNC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN6O/c22-15-8-10-17(11-9-15)26-27-20(29)18-7-4-14-28(18)21-23-13-12-19(25-21)24-16-5-2-1-3-6-16/h1-3,5-6,8-13,18,26H,4,7,14H2,(H,27,29)(H,23,24,25)/t18-/m0/s1