6-(benzotriazol-1-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine

Systemtic Name: 6-(benzotriazol-1-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-N-ethyl-5-nitro-N-phenyl-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-N-ethyl-5-nitro-N-phenylpyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C18H15N7O2 MolecularWeight: 361.3574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N7O2/c1-2-23(13-8-4-3-5-9-13)17-16(25(26)27)18(20-12-19-17)24-15-11-7-6-10-14(15)21-22-24/h3-12H,2H2,1H3