N-[4-[[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)amino]phenyl]acetamide CAS Name: N-[4-[[6-(2,3-dihydroindol-1-yl)-5-nitro-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[6-(2,3-dihydroindol-1-yl)-5-nitropyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)amino]phenyl]acetamide Formula: C20H18N6O3 MolecularWeight: 390.39532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

InChI

InChI=1S/C20H18N6O3/c1-13(27)23-15-6-8-16(9-7-15)24-19-18(26(28)29)20(22-12-21-19)25-11-10-14-4-2-3-5-17(14)25/h2-9,12H,10-11H2,1H3,(H,23,27)(H,21,22,24)