4-[(3-methylindol-1-yl)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(3-methylindol-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(3-methylindol-1-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(3-methyl-1-indolyl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(3-methylindol-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(3-methylindol-1-yl)methyl]thiazole-2-carboxylic acid Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CC=C12)CC3=CSC(=N3)C(=O)O

Isomeric SMILES

CC1=CN(C2=CC=CC=C12)CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C14H12N2O2S/c1-9-6-16(12-5-3-2-4-11(9)12)7-10-8-19-13(15-10)14(17)18/h2-6,8H,7H2,1H3,(H,17,18)