4a-methyl-8-nitro-2,3,4,5-tetrahydropyrimido[1,6-a]benzimidazole-1-thione

Systemtic Name: 4a-methyl-8-nitro-2,3,4,5-tetrahydropyrimido[1,6-a]benzimidazole-1-thione Openeye Name: 4a-methyl-8-nitro-2,3,4,5-tetrahydropyrimido[1,6-a]benzimidazole-1-thione CAS Name: 4a-methyl-8-nitro-2,3,4,5-tetrahydropyrimido[1,6-a]benzimidazole-1-thione IUPAC Name: 4a-methyl-8-nitro-2,3,4,5-tetrahydropyrimido[1,6-a]benzimidazole-1-thione Traditional Name: 4a-methyl-8-nitro-2,3,4,5-tetrahydropyrimido[1,6-a]benzimidazole-1-thione Formula: C11H12N4O2S MolecularWeight: 264.30358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCNC(=S)N1C3=C(N2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC12CCNC(=S)N1C3=C(N2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O2S/c1-11-4-5-12-10(18)14(11)9-6-7(15(16)17)2-3-8(9)13-11/h2-3,6,13H,4-5H2,1H3,(H,12,18)