methyl 4-methyl-2-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-methyl-2-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-(2-isopropylquinazolin-4-yl)sulfanylacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(2-propan-2-yl-4-quinazolinyl)thio]ethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(2-isopropylquinazolin-4-yl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(C)C)C(=O)OC

InChI

InChI=1S/C19H20N4O3S2/c1-10(2)16-21-13-8-6-5-7-12(13)17(23-16)27-9-14(24)22-19-20-11(3)15(28-19)18(25)26-4/h5-8,10H,9H2,1-4H3,(H,20,22,24)