6-(pentylamino)-1H-benzimidazole-4,7-dione

Systemtic Name: 6-(pentylamino)-1H-benzimidazole-4,7-dione Openeye Name: 6-(pentylamino)-1H-benzimidazole-4,7-dione CAS Name: 6-(pentylamino)-1H-benzimidazole-4,7-dione IUPAC Name: 6-(pentylamino)-1H-benzimidazole-4,7-dione Traditional Name: 6-(amylamino)-1H-benzimidazole-4,7-quinone Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=CC(=O)C2=C(C1=O)NC=N2

Isomeric SMILES

CCCCCNC1=CC(=O)C2=C(C1=O)NC=N2

InChI

InChI=1S/C12H15N3O2/c1-2-3-4-5-13-8-6-9(16)10-11(12(8)17)15-7-14-10/h6-7,13H,2-5H2,1H3,(H,14,15)