2-methylpropyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylbutanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylbutanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]butanoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxobutyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylbutanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-[(4,8-dimethyl-2-quinolyl)thio]butanoylamino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC(C)C)C)SC2=NC3=C(C=CC=C3C)C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC(C)C)C)SC2=NC3=C(C=CC=C3C)C(=C2)C

InChI

InChI=1S/C24H29N3O3S2/c1-7-18(31-19-11-15(5)17-10-8-9-14(4)20(17)26-19)22(28)27-24-25-16(6)21(32-24)23(29)30-12-13(2)3/h8-11,13,18H,7,12H2,1-6H3,(H,25,27,28)