ethyl 5-ethyl-2-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-(3-imidazo[1,5-a]pyridinylthio)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(imidazo[1,5-a]pyridin-3-ylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CSC2=NC=C3N2C=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CSC2=NC=C3N2C=CC=C3)C(=O)OCC

InChI

InChI=1S/C18H19N3O3S2/c1-3-13-9-14(17(23)24-4-2)16(26-13)20-15(22)11-25-18-19-10-12-7-5-6-8-21(12)18/h5-10H,3-4,11H2,1-2H3,(H,20,22)