5-chloranyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene

Systemtic Name: 5-chloranyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene Openeye Name: 5-chloro-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene CAS Name: 5-chloro-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene IUPAC Name: 5-chloro-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene Traditional Name: 5-chloro-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene Formula: C12H12ClN3O2S MolecularWeight: 297.76058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=S)N1)C)Cl.C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=S)N1)C)Cl.C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C6H7ClN2S.C6H5NO2/c1-3-5(7)4(2)9-6(10)8-3;8-7(9)6-4-2-1-3-5-6/h1-2H3,(H,8,9,10);1-5H