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2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanylpyrimidine

2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanylpyrimidine

Systemtic Name:2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanylpyrimidine
Openeye Name:2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanylpyrimidine
CAS Name:2-[[(1S)-1-(3-nitrophenyl)ethyl]thio]pyrimidine
IUPAC Name:2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanylpyrimidine
Traditional Name:2-[[(1S)-1-(3-nitrophenyl)ethyl]thio]pyrimidine
Formula: C12H11N3O2S
MolecularWeight: 261.29964
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC=CC=N2


Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC=CC=N2


InChI

InChI=1S/C12H11N3O2S/c1-9(18-12-13-6-3-7-14-12)10-4-2-5-11(8-10)15(16)17/h2-9H,1H3/t9-/m0/s1


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