2-[3-(1,3-benzothiazol-2-yl)-2,5-dimethyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(1,3-benzothiazol-2-yl)-2,5-dimethyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(1,3-benzothiazol-2-yl)-2,5-dimethyl-indol-1-yl]acetic acid CAS Name: 2-[3-(1,3-benzothiazol-2-yl)-2,5-dimethyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(1,3-benzothiazol-2-yl)-2,5-dimethylindol-1-yl]acetic acid Traditional Name: 2-[3-(1,3-benzothiazol-2-yl)-2,5-dimethyl-indol-1-yl]acetic acid Formula: C19H16N2O2S MolecularWeight: 336.40754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C3=NC4=CC=CC=C4S3)C)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C3=NC4=CC=CC=C4S3)C)CC(=O)O

InChI

InChI=1S/C19H16N2O2S/c1-11-7-8-15-13(9-11)18(12(2)21(15)10-17(22)23)19-20-14-5-3-4-6-16(14)24-19/h3-9H,10H2,1-2H3,(H,22,23)