2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)ethanoic acid

Systemtic Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)ethanoic acid Openeye Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)acetic acid CAS Name: 2-(6-benzimidazolo[1,2-c]quinazolinylthio)acetic acid IUPAC Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)acetic acid Traditional Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylthio)acetic acid Formula: C16H11N3O2S MolecularWeight: 309.34244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC(=O)O

InChI

InChI=1S/C16H11N3O2S/c20-14(21)9-22-16-18-11-6-2-1-5-10(11)15-17-12-7-3-4-8-13(12)19(15)16/h1-8H,9H2,(H,20,21)