5-propan-2-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-yl)-1,3-thiazole-4-carboxylic acid

Systemtic Name: 5-propan-2-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-yl)-1,3-thiazole-4-carboxylic acid Openeye Name: 5-isopropyl-2-(1,2,3,4-tetrahydroisoquinolin-3-yl)thiazole-4-carboxylic acid CAS Name: 5-propan-2-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-yl)-4-thiazolecarboxylic acid IUPAC Name: 5-propan-2-yl-2-(1,2,3,4-tetrahydroisoquinolin-3-yl)-1,3-thiazole-4-carboxylic acid Traditional Name: 5-isopropyl-2-(1,2,3,4-tetrahydroisoquinolin-3-yl)thiazole-4-carboxylic acid Formula: C16H18N2O2S MolecularWeight: 302.39132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=C(S1)C2CC3=CC=CC=C3CN2)C(=O)O

Isomeric SMILES

CC(C)C1=C(N=C(S1)C2CC3=CC=CC=C3CN2)C(=O)O

InChI

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