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

Systemtic Name: 5-ethyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene Openeye Name: 5-ethyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene CAS Name: 5-ethyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene IUPAC Name: 5-ethyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene Traditional Name: 5-ethyl-4,6-dimethyl-1H-pyrimidine-2-thione; nitrobenzene Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=S)N=C1C)C.C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(NC(=S)N=C1C)C.C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H12N2S.C6H5NO2/c1-4-7-5(2)9-8(11)10-6(7)3;8-7(9)6-4-2-1-3-5-6/h4H2,1-3H3,(H,9,10,11);1-5H