N-[6-[(4-chlorophenyl)amino]-2-cyano-pyrimidin-4-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-[6-[(4-chlorophenyl)amino]-2-cyano-pyrimidin-4-yl]pyrrolidine-2-carboxamide Openeye Name: N-[6-(4-chloroanilino)-2-cyano-pyrimidin-4-yl]pyrrolidine-2-carboxamide CAS Name: N-[6-(4-chloroanilino)-2-cyano-4-pyrimidinyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[6-(4-chloroanilino)-2-cyanopyrimidin-4-yl]pyrrolidine-2-carboxamide Traditional Name: N-[6-(4-chloroanilino)-2-cyano-pyrimidin-4-yl]pyrrolidine-2-carboxamide Formula: C16H15ClN6O MolecularWeight: 342.7829

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC2=NC(=NC(=C2)NC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1CC(NC1)C(=O)NC2=NC(=NC(=C2)NC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C16H15ClN6O/c17-10-3-5-11(6-4-10)20-13-8-14(22-15(9-18)21-13)23-16(24)12-2-1-7-19-12/h3-6,8,12,19H,1-2,7H2,(H2,20,21,22,23,24)