N-[4-[[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[6-(1-benzotriazolyl)-5-nitro-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[6-(benzotriazol-1-yl)-5-nitropyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide Formula: C18H14N8O3 MolecularWeight: 390.35556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H14N8O3/c1-11(27)21-12-6-8-13(9-7-12)22-17-16(26(28)29)18(20-10-19-17)25-15-5-3-2-4-14(15)23-24-25/h2-10H,1H3,(H,21,27)(H,19,20,22)