2-(1,2-diethylindol-3-yl)-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(1,2-diethylindol-3-yl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(1,2-diethylindol-3-yl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(1,2-diethyl-3-indolyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(1,2-diethylindol-3-yl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(1,2-diethylindol-3-yl)-4-methyl-thiazole-5-carboxylic acid Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N1CC)C3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N1CC)C3=NC(=C(S3)C(=O)O)C

InChI

InChI=1S/C17H18N2O2S/c1-4-12-14(16-18-10(3)15(22-16)17(20)21)11-8-6-7-9-13(11)19(12)5-2/h6-9H,4-5H2,1-3H3,(H,20,21)