2-[(1S)-1-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(1S)-1-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(1S)-1-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(1S)-1-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(1S)-1-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(1S)-1-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C(C)N2CCCC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)[C@H](C)N2CCCC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H18N2O2S/c1-10-14(16(19)20)21-15(17-10)11(2)18-9-5-7-12-6-3-4-8-13(12)18/h3-4,6,8,11H,5,7,9H2,1-2H3,(H,19,20)/t11-/m0/s1