ethyl 4-(furan-2-yl)-2-[2-(4-methylquinazolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(furan-2-yl)-2-[2-(4-methylquinazolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-furyl)-2-[[2-(4-methylquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-furanyl)-2-[[2-[(4-methyl-2-quinazolinyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-yl)-2-[[2-(4-methylquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-furyl)-2-[[2-[(4-methylquinazolin-2-yl)thio]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H19N3O4S2 MolecularWeight: 453.53396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC3=NC4=CC=CC=C4C(=N3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC3=NC4=CC=CC=C4C(=N3)C

InChI

InChI=1S/C22H19N3O4S2/c1-3-28-21(27)19-15(17-9-6-10-29-17)11-30-20(19)25-18(26)12-31-22-23-13(2)14-7-4-5-8-16(14)24-22/h4-11H,3,12H2,1-2H3,(H,25,26)