methyl 3-[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2-(2-furyl)quinazolin-4-yl]sulfanylacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[[2-(2-furanyl)-4-quinazolinyl]thio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[2-(2-furyl)quinazolin-4-yl]thio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H19N3O4S MolecularWeight: 433.47966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C23H19N3O4S/c1-14-9-10-15(23(28)29-2)12-18(14)24-20(27)13-31-22-16-6-3-4-7-17(16)25-21(26-22)19-8-5-11-30-19/h3-12H,13H2,1-2H3,(H,24,27)