imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid 2-imidazo[1,2-a]pyridinylmethyl ester IUPAC Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid imidazo[1,2-a]pyridin-2-ylmethyl ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CN2C=C1)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NC(=CN2C=C1)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-16(11-24-14-6-4-13(5-7-14)19(21)22)23-10-12-9-18-8-2-1-3-15(18)17-12/h1-9H,10-11H2