ethyl 6-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(3-imidazo[1,5-a]pyridinylthio)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(imidazo[1,5-a]pyridin-3-ylthio)methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC=C4N3C=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC=C4N3C=CC=C4

InChI

InChI=1S/C21H20N4O3S/c1-2-28-19(26)17-16(13-29-21-22-12-15-10-6-7-11-25(15)21)23-20(27)24-18(17)14-8-4-3-5-9-14/h3-12,18H,2,13H2,1H3,(H2,23,24,27)