6-(2,3-dihydroindol-1-yl)-N-(4-ethylphenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(2,3-dihydroindol-1-yl)-N-(4-ethylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(4-ethylphenyl)-6-indolin-1-yl-5-nitro-pyrimidin-4-amine CAS Name: 6-(2,3-dihydroindol-1-yl)-N-(4-ethylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(2,3-dihydroindol-1-yl)-N-(4-ethylphenyl)-5-nitropyrimidin-4-amine Traditional Name: (4-ethylphenyl)-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)amine Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

InChI

InChI=1S/C20H19N5O2/c1-2-14-7-9-16(10-8-14)23-19-18(25(26)27)20(22-13-21-19)24-12-11-15-5-3-4-6-17(15)24/h3-10,13H,2,11-12H2,1H3,(H,21,22,23)