methyl 4,5-dimethyl-2-[2-(2-methylquinazolin-4-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-(2-methylquinazolin-4-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-(2-methylquinazolin-4-yl)sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-[(2-methyl-4-quinazolinyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(2-methylquinazolin-4-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[(2-methylquinazolin-4-yl)thio]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C)C

InChI

InChI=1S/C19H19N3O3S2/c1-10-11(2)27-18(16(10)19(24)25-4)22-15(23)9-26-17-13-7-5-6-8-14(13)20-12(3)21-17/h5-8H,9H2,1-4H3,(H,22,23)