N,N-diethyl-6-(5-nitrothiophen-2-yl)pyrimidin-4-amine hydrochloride

Systemtic Name: N,N-diethyl-6-(5-nitrothiophen-2-yl)pyrimidin-4-amine hydrochloride Openeye Name: N,N-diethyl-6-(5-nitro-2-thienyl)pyrimidin-4-amine hydrochloride CAS Name: N,N-diethyl-6-(5-nitro-2-thiophenyl)-4-pyrimidinamine hydrochloride IUPAC Name: N,N-diethyl-6-(5-nitrothiophen-2-yl)pyrimidin-4-amine hydrochloride Traditional Name: diethyl-[6-(5-nitro-2-thienyl)pyrimidin-4-yl]amine hydrochloride Formula: C12H15ClN4O2S MolecularWeight: 314.7911

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=NC(=C1)C2=CC=C(S2)[N+](=O)[O-].Cl

Isomeric SMILES

CCN(CC)C1=NC=NC(=C1)C2=CC=C(S2)[N+](=O)[O-].Cl

InChI

InChI=1S/C12H14N4O2S.ClH/c1-3-15(4-2)11-7-9(13-8-14-11)10-5-6-12(19-10)16(17)18;/h5-8H,3-4H2,1-2H3;1H