N-[6-(2,2-diphenylhydrazinyl)-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[6-(2,2-diphenylhydrazinyl)-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine Openeye Name: N-[6-(2,2-diphenylhydrazino)-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine CAS Name: N-[6-(2,2-diphenylhydrazinyl)-5-nitro-4-pyrimidinyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[6-(2,2-diphenylhydrazinyl)-5-nitropyrimidin-4-yl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[6-(N',N'-diphenylhydrazino)-5-nitro-pyrimidin-4-yl]amine Formula: C23H17N7O2S MolecularWeight: 455.49178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H17N7O2S/c31-30(32)20-21(27-23-26-18-13-7-8-14-19(18)33-23)24-15-25-22(20)28-29(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15H,(H2,24,25,26,27,28)