N-[4-[[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[5-nitro-6-(propan-2-ylamino)-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide Formula: C15H18N6O3 MolecularWeight: 330.34182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N6O3/c1-9(2)18-14-13(21(23)24)15(17-8-16-14)20-12-6-4-11(5-7-12)19-10(3)22/h4-9H,1-3H3,(H,19,22)(H2,16,17,18,20)