prop-2-enyl 2-[3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: prop-2-enyl 2-[3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: allyl 2-[3-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[3-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]amino]-4-methyl-5-thiazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-[(4,8-dimethyl-2-quinolyl)thio]propanoylamino]-4-methyl-thiazole-5-carboxylic acid allyl ester Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)NC3=NC(=C(S3)C(=O)OCC=C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)NC3=NC(=C(S3)C(=O)OCC=C)C

InChI

InChI=1S/C22H23N3O3S2/c1-5-10-28-21(27)20-15(4)23-22(30-20)24-17(26)9-11-29-18-12-14(3)16-8-6-7-13(2)19(16)25-18/h5-8,12H,1,9-11H2,2-4H3,(H,23,24,26)