methyl 2-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[2-(4-ethylphenyl)-4-quinolinyl]-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=C(S4)C(=O)OC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=C(S4)C(=O)OC)C

InChI

InChI=1S/C24H21N3O3S/c1-4-15-9-11-16(12-10-15)20-13-18(17-7-5-6-8-19(17)26-20)22(28)27-24-25-14(2)21(31-24)23(29)30-3/h5-13H,4H2,1-3H3,(H,25,27,28)