4-[(4-chlorophenyl)amino]-6-morpholin-4-yl-5-nitro-pyrimidine-2-carbonitrile

Systemtic Name: 4-[(4-chlorophenyl)amino]-6-morpholin-4-yl-5-nitro-pyrimidine-2-carbonitrile Openeye Name: 4-(4-chloroanilino)-6-morpholino-5-nitro-pyrimidine-2-carbonitrile CAS Name: 4-(4-chloroanilino)-6-(4-morpholinyl)-5-nitro-2-pyrimidinecarbonitrile IUPAC Name: 4-(4-chloroanilino)-6-morpholin-4-yl-5-nitropyrimidine-2-carbonitrile Traditional Name: 4-(4-chloroanilino)-6-morpholino-5-nitro-pyrimidine-2-carbonitrile Formula: C15H13ClN6O3 MolecularWeight: 360.75512

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H13ClN6O3/c16-10-1-3-11(4-2-10)18-14-13(22(23)24)15(20-12(9-17)19-14)21-5-7-25-8-6-21/h1-4H,5-8H2,(H,18,19,20)