4-chloranyl-5-nitro-6-prop-2-enylsulfanyl-pyrimidine

Systemtic Name: 4-chloranyl-5-nitro-6-prop-2-enylsulfanyl-pyrimidine Openeye Name: 4-allylsulfanyl-6-chloro-5-nitro-pyrimidine CAS Name: 4-chloro-5-nitro-6-(prop-2-enylthio)pyrimidine IUPAC Name: 4-chloro-5-nitro-6-prop-2-enylsulfanylpyrimidine Traditional Name: 4-(allylthio)-6-chloro-5-nitro-pyrimidine Formula: C7H6ClN3O2S MolecularWeight: 231.65944

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C(=NC=N1)Cl)[N+](=O)[O-]

Isomeric SMILES

C=CCSC1=C(C(=NC=N1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C7H6ClN3O2S/c1-2-3-14-7-5(11(12)13)6(8)9-4-10-7/h2,4H,1,3H2