1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-2,3-dihydroindole

Systemtic Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-2,3-dihydroindole Openeye Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]indoline CAS Name: 1-[6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinyl]-2,3-dihydroindole IUPAC Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-yl]-2,3-dihydroindole Traditional Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]indoline Formula: C17H16N6O2 MolecularWeight: 336.34794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C(=NC=N2)N3CCC4=CC=CC=C43)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C(=NC=N2)N3CCC4=CC=CC=C43)[N+](=O)[O-])C

InChI

InChI=1S/C17H16N6O2/c1-11-9-12(2)22(20-11)17-15(23(24)25)16(18-10-19-17)21-8-7-13-5-3-4-6-14(13)21/h3-6,9-10H,7-8H2,1-2H3