methyl 4-[2-(2-methylquinazolin-4-yl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2-methylquinazolin-4-yl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2-methylquinazolin-4-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(2-methyl-4-quinazolinyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-methylquinazolin-4-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(2-methylquinazolin-4-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H17N3O3S/c1-12-20-16-6-4-3-5-15(16)18(21-12)26-11-17(23)22-14-9-7-13(8-10-14)19(24)25-2/h3-10H,11H2,1-2H3,(H,22,23)