methyl 2-imidazo[1,5-a]pyridin-3-ylsulfanyl-5-nitro-benzoate

Systemtic Name: methyl 2-imidazo[1,5-a]pyridin-3-ylsulfanyl-5-nitro-benzoate Openeye Name: methyl 2-imidazo[1,5-a]pyridin-3-ylsulfanyl-5-nitro-benzoate CAS Name: 2-(3-imidazo[1,5-a]pyridinylthio)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-imidazo[1,5-a]pyridin-3-ylsulfanyl-5-nitrobenzoate Traditional Name: 2-(imidazo[1,5-a]pyridin-3-ylthio)-5-nitro-benzoic acid methyl ester Formula: C15H11N3O4S MolecularWeight: 329.33054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=NC=C3N2C=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=NC=C3N2C=CC=C3

InChI

InChI=1S/C15H11N3O4S/c1-22-14(19)12-8-10(18(20)21)5-6-13(12)23-15-16-9-11-4-2-3-7-17(11)15/h2-9H,1H3