6-(4-chlorophenyl)sulfanyl-N-ethyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chlorophenyl)sulfanyl-N-ethyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chlorophenyl)sulfanyl-N-ethyl-5-nitro-pyrimidin-4-amine CAS Name: 6-[(4-chlorophenyl)thio]-N-ethyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chlorophenyl)sulfanyl-N-ethyl-5-nitropyrimidin-4-amine Traditional Name: [6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]-ethyl-amine Formula: C12H11ClN4O2S MolecularWeight: 310.75934

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=NC=N1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C(=NC=N1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H11ClN4O2S/c1-2-14-11-10(17(18)19)12(16-7-15-11)20-9-5-3-8(13)4-6-9/h3-7H,2H2,1H3,(H,14,15,16)