2-[[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol

Systemtic Name: 2-[[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Openeye Name: 2-[[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol CAS Name: 2-[[6-[(4-chlorophenyl)thio]-5-nitro-4-pyrimidinyl]-ethylamino]ethanol IUPAC Name: 2-[[6-(4-chlorophenyl)sulfanyl-5-nitropyrimidin-4-yl]-ethylamino]ethanol Traditional Name: 2-[[6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Formula: C14H15ClN4O3S MolecularWeight: 354.8119

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=C(C(=NC=N1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CCO)C1=C(C(=NC=N1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H15ClN4O3S/c1-2-18(7-8-20)13-12(19(21)22)14(17-9-16-13)23-11-5-3-10(15)4-6-11/h3-6,9,20H,2,7-8H2,1H3