2-[1-[(5-bromanyl-1,3-benzothiazol-2-yl)methyl]-5-chloranyl-indazol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(5-bromanyl-1,3-benzothiazol-2-yl)methyl]-5-chloranyl-indazol-3-yl]ethanoic acid Openeye Name: 2-[1-[(5-bromo-1,3-benzothiazol-2-yl)methyl]-5-chloro-indazol-3-yl]acetic acid CAS Name: 2-[1-[(5-bromo-1,3-benzothiazol-2-yl)methyl]-5-chloro-3-indazolyl]acetic acid IUPAC Name: 2-[1-[(5-bromo-1,3-benzothiazol-2-yl)methyl]-5-chloroindazol-3-yl]acetic acid Traditional Name: 2-[1-[(5-bromo-1,3-benzothiazol-2-yl)methyl]-5-chloro-indazol-3-yl]acetic acid Formula: C17H11BrClN3O2S MolecularWeight: 436.71014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=NN2CC3=NC4=C(S3)C=CC(=C4)Br)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=NN2CC3=NC4=C(S3)C=CC(=C4)Br)CC(=O)O

InChI

InChI=1S/C17H11BrClN3O2S/c18-9-1-4-15-13(5-9)20-16(25-15)8-22-14-3-2-10(19)6-11(14)12(21-22)7-17(23)24/h1-6H,7-8H2,(H,23,24)