5-nitro-6-[phenyl(propyl)amino]-1H-pyrimidine-4-thione

Systemtic Name: 5-nitro-6-[phenyl(propyl)amino]-1H-pyrimidine-4-thione Openeye Name: 5-nitro-6-(N-propylanilino)-1H-pyrimidine-4-thione CAS Name: 5-nitro-6-(N-propylanilino)-1H-pyrimidine-4-thione IUPAC Name: 5-nitro-6-(N-propylanilino)-1H-pyrimidine-4-thione Traditional Name: 5-nitro-6-(N-propylanilino)-1H-pyrimidine-4-thione Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1)C2=C(C(=S)N=CN2)[N+](=O)[O-]

Isomeric SMILES

CCCN(C1=CC=CC=C1)C2=C(C(=S)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O2S/c1-2-8-16(10-6-4-3-5-7-10)12-11(17(18)19)13(20)15-9-14-12/h3-7,9H,2,8H2,1H3,(H,14,15,20)