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

Systemtic Name: 6-(2,3-dihydroindol-1-yl)-5-nitro-N-(4-propan-2-ylphenyl)pyrimidin-4-amine Openeye Name: 6-indolin-1-yl-N-(4-isopropylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(2,3-dihydroindol-1-yl)-5-nitro-N-(4-propan-2-ylphenyl)-4-pyrimidinamine IUPAC Name: 6-(2,3-dihydroindol-1-yl)-5-nitro-N-(4-propan-2-ylphenyl)pyrimidin-4-amine Traditional Name: (6-indolin-1-yl-5-nitro-pyrimidin-4-yl)-p-cumenyl-amine Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O2/c1-14(2)15-7-9-17(10-8-15)24-20-19(26(27)28)21(23-13-22-20)25-12-11-16-5-3-4-6-18(16)25/h3-10,13-14H,11-12H2,1-2H3,(H,22,23,24)