butyl 4-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoylamino)benzoate

Systemtic Name: butyl 4-(2-imidazo[1,5-a]pyridin-3-ylsulfanylethanoylamino)benzoate Openeye Name: butyl 4-[(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)amino]benzoate CAS Name: 4-[[2-(3-imidazo[1,5-a]pyridinylthio)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2-imidazo[1,5-a]pyridin-3-ylsulfanylacetyl)amino]benzoate Traditional Name: 4-[[2-(imidazo[1,5-a]pyridin-3-ylthio)acetyl]amino]benzoic acid butyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=C3N2C=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=C3N2C=CC=C3

InChI

InChI=1S/C20H21N3O3S/c1-2-3-12-26-19(25)15-7-9-16(10-8-15)22-18(24)14-27-20-21-13-17-6-4-5-11-23(17)20/h4-11,13H,2-3,12,14H2,1H3,(H,22,24)