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

Systemtic Name: N-[6-(2-tert-butylhydrazinyl)-5-nitro-pyrimidin-4-yl]-6-methyl-1,3-benzothiazol-2-amine Openeye Name: N-[6-(2-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]-6-methyl-1,3-benzothiazol-2-amine CAS Name: N-[6-(tert-butylhydrazo)-5-nitro-4-pyrimidinyl]-6-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-[6-(2-tert-butylhydrazinyl)-5-nitropyrimidin-4-yl]-6-methyl-1,3-benzothiazol-2-amine Traditional Name: [6-(N'-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]-(6-methyl-1,3-benzothiazol-2-yl)amine Formula: C16H19N7O2S MolecularWeight: 373.43276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)NNC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)NNC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19N7O2S/c1-9-5-6-10-11(7-9)26-15(19-10)20-13-12(23(24)25)14(18-8-17-13)21-22-16(2,3)4/h5-8,22H,1-4H3,(H2,17,18,19,20,21)