N2-(2-morpholin-4-ylethyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(2-morpholin-4-ylethyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N2-(2-morpholinoethyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine CAS Name: N2-[2-(4-morpholinyl)ethyl]-5-nitro-N4-phenylpyrimidine-2,4,6-triamine IUPAC Name: 2-N-(2-morpholin-4-ylethyl)-5-nitro-4-N-phenylpyrimidine-2,4,6-triamine Traditional Name: (4-amino-6-anilino-5-nitro-pyrimidin-2-yl)-(2-morpholinoethyl)amine Formula: C16H21N7O3 MolecularWeight: 359.38304

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC(=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

C1COCCN1CCNC2=NC(=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C16H21N7O3/c17-14-13(23(24)25)15(19-12-4-2-1-3-5-12)21-16(20-14)18-6-7-22-8-10-26-11-9-22/h1-5H,6-11H2,(H4,17,18,19,20,21)