2-[ethyl-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]amino]ethanol

Systemtic Name: 2-[ethyl-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[ethyl-[6-(4-isopropylanilino)-5-nitro-pyrimidin-4-yl]amino]ethanol CAS Name: 2-[ethyl-[5-nitro-6-(4-propan-2-ylanilino)-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[ethyl-[5-nitro-6-(4-propan-2-ylanilino)pyrimidin-4-yl]amino]ethanol Traditional Name: 2-[(6-cumidino-5-nitro-pyrimidin-4-yl)-ethyl-amino]ethanol Formula: C17H23N5O3 MolecularWeight: 345.39622

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C17H23N5O3/c1-4-21(9-10-23)17-15(22(24)25)16(18-11-19-17)20-14-7-5-13(6-8-14)12(2)3/h5-8,11-12,23H,4,9-10H2,1-3H3,(H,18,19,20)