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

Systemtic Name: methyl 2-[2-(2-ethylquinazolin-4-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-(2-ethylquinazolin-4-yl)sulfanylacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(2-ethyl-4-quinazolinyl)thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-ethylquinazolin-4-yl)sulfanylacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(2-ethylquinazolin-4-yl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=NC(=C(S3)C(=O)OC)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=NC(=C(S3)C(=O)OC)C

InChI

InChI=1S/C18H18N4O3S2/c1-4-13-20-12-8-6-5-7-11(12)16(21-13)26-9-14(23)22-18-19-10(2)15(27-18)17(24)25-3/h5-8H,4,9H2,1-3H3,(H,19,22,23)