methyl 5-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-(3-imidazo[1,5-a]pyridinylthio)-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(imidazo[1,5-a]pyridin-3-ylthio)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=C3N2C=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=C3N2C=CC=C3

InChI

InChI=1S/C17H17N3O3S/c1-10-14(16(22)23-3)11(2)19-15(10)13(21)9-24-17-18-8-12-6-4-5-7-20(12)17/h4-8,19H,9H2,1-3H3