2-[6-chloranyl-3-(2-methylpropyl)indol-1-yl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[6-chloranyl-3-(2-methylpropyl)indol-1-yl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(6-chloro-3-isobutyl-indol-1-yl)thiazole-5-carboxylic acid CAS Name: 2-[6-chloro-3-(2-methylpropyl)-1-indolyl]-5-thiazolecarboxylic acid IUPAC Name: 2-[6-chloro-3-(2-methylpropyl)indol-1-yl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(6-chloro-3-isobutyl-indol-1-yl)thiazole-5-carboxylic acid Formula: C16H15ClN2O2S MolecularWeight: 334.8205

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN(C2=C1C=CC(=C2)Cl)C3=NC=C(S3)C(=O)O

Isomeric SMILES

CC(C)CC1=CN(C2=C1C=CC(=C2)Cl)C3=NC=C(S3)C(=O)O

InChI

InChI=1S/C16H15ClN2O2S/c1-9(2)5-10-8-19(13-6-11(17)3-4-12(10)13)16-18-7-14(22-16)15(20)21/h3-4,6-9H,5H2,1-2H3,(H,20,21)