ethyl 2,4-dimethyl-5-(2-quinazolin-4-ylsulfanylethanoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-(2-quinazolin-4-ylsulfanylethanoyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-(2-quinazolin-4-ylsulfanylacetyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-(4-quinazolinylthio)ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-(2-quinazolin-4-ylsulfanylacetyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(quinazolin-4-ylthio)acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CSC2=NC=NC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CSC2=NC=NC3=CC=CC=C32)C

InChI

InChI=1S/C19H19N3O3S/c1-4-25-19(24)16-11(2)17(22-12(16)3)15(23)9-26-18-13-7-5-6-8-14(13)20-10-21-18/h5-8,10,22H,4,9H2,1-3H3