5-chloranyl-N-(3-chloranyl-2-morpholin-4-yl-phenyl)-2-[(phenylmethyl)amino]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(3-chloranyl-2-morpholin-4-yl-phenyl)-2-[(phenylmethyl)amino]pyrimidine-4-carboxamide Openeye Name: 2-(benzylamino)-5-chloro-N-(3-chloro-2-morpholino-phenyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-chloro-2-(4-morpholinyl)phenyl]-2-[(phenylmethyl)amino]-4-pyrimidinecarboxamide IUPAC Name: 2-(benzylamino)-5-chloro-N-(3-chloro-2-morpholin-4-ylphenyl)pyrimidine-4-carboxamide Traditional Name: 2-(benzylamino)-5-chloro-N-(3-chloro-2-morpholino-phenyl)pyrimidine-4-carboxamide Formula: C22H21Cl2N5O2 MolecularWeight: 458.34044

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=C2Cl)NC(=O)C3=NC(=NC=C3Cl)NCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=CC=C2Cl)NC(=O)C3=NC(=NC=C3Cl)NCC4=CC=CC=C4

InChI

InChI=1S/C22H21Cl2N5O2/c23-16-7-4-8-18(20(16)29-9-11-31-12-10-29)27-21(30)19-17(24)14-26-22(28-19)25-13-15-5-2-1-3-6-15/h1-8,14H,9-13H2,(H,27,30)(H,25,26,28)