N'-[4-(4-morpholin-4-ylphenyl)pyrimidin-2-yl]-N-(5-nitropyridin-2-yl)ethane-1,2-diamine

Systemtic Name: N'-[4-(4-morpholin-4-ylphenyl)pyrimidin-2-yl]-N-(5-nitropyridin-2-yl)ethane-1,2-diamine Openeye Name: N'-[4-(4-morpholinophenyl)pyrimidin-2-yl]-N-(5-nitro-2-pyridyl)ethane-1,2-diamine CAS Name: N'-[4-[4-(4-morpholinyl)phenyl]-2-pyrimidinyl]-N-(5-nitro-2-pyridinyl)ethane-1,2-diamine IUPAC Name: N'-[4-(4-morpholin-4-ylphenyl)pyrimidin-2-yl]-N-(5-nitropyridin-2-yl)ethane-1,2-diamine Traditional Name: [4-(4-morpholinophenyl)pyrimidin-2-yl]-[2-[(5-nitro-2-pyridyl)amino]ethyl]amine Formula: C21H23N7O3 MolecularWeight: 421.45242

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C3=NC(=NC=C3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C3=NC(=NC=C3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N7O3/c29-28(30)18-5-6-20(25-15-18)22-9-10-24-21-23-8-7-19(26-21)16-1-3-17(4-2-16)27-11-13-31-14-12-27/h1-8,15H,9-14H2,(H,22,25)(H,23,24,26)