4,5-dimethyl-N-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-1,3-thiazol-2-amine

Systemtic Name: 4,5-dimethyl-N-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-1,3-thiazol-2-amine Openeye Name: 4,5-dimethyl-N-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]thiazol-2-amine CAS Name: 4,5-dimethyl-N-[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]-2-thiazolamine IUPAC Name: 4,5-dimethyl-N-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-1,3-thiazol-2-amine Traditional Name: (4,5-dimethylthiazol-2-yl)-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H19N7O2S MolecularWeight: 349.41136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C)C

Isomeric SMILES

CC1=C(SC(=N1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C)C

InChI

InChI=1S/C14H19N7O2S/c1-9-10(2)24-14(17-9)18-12-11(21(22)23)13(16-8-15-12)20-6-4-19(3)5-7-20/h8H,4-7H2,1-3H3,(H,15,16,17,18)