3-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]indol-3-yl]propanoic acid

Systemtic Name: 3-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]indol-3-yl]propanoic acid Openeye Name: 3-[1-[(2-methylthiazol-4-yl)methyl]indol-3-yl]propanoic acid CAS Name: 3-[1-[(2-methyl-4-thiazolyl)methyl]-3-indolyl]propanoic acid IUPAC Name: 3-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]indol-3-yl]propanoic acid Traditional Name: 3-[1-[(2-methylthiazol-4-yl)methyl]indol-3-yl]propionic acid Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2C=C(C3=CC=CC=C32)CCC(=O)O

Isomeric SMILES

CC1=NC(=CS1)CN2C=C(C3=CC=CC=C32)CCC(=O)O

InChI

InChI=1S/C16H16N2O2S/c1-11-17-13(10-21-11)9-18-8-12(6-7-16(19)20)14-4-2-3-5-15(14)18/h2-5,8,10H,6-7,9H2,1H3,(H,19,20)