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3-(2-hydroxyphenyl)sulfanyl-6-(imidazol-1-ylmethyl)-1-benzothiophene-2-carboxylic acid

3-(2-hydroxyphenyl)sulfanyl-6-(imidazol-1-ylmethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name:3-(2-hydroxyphenyl)sulfanyl-6-(imidazol-1-ylmethyl)-1-benzothiophene-2-carboxylic acid
Openeye Name:3-(2-hydroxyphenyl)sulfanyl-6-(imidazol-1-ylmethyl)benzothiophene-2-carboxylic acid
CAS Name:3-[(2-hydroxyphenyl)thio]-6-(1-imidazolylmethyl)-1-benzothiophene-2-carboxylic acid
IUPAC Name:3-(2-hydroxyphenyl)sulfanyl-6-(imidazol-1-ylmethyl)-1-benzothiophene-2-carboxylic acid
Traditional Name:3-[(2-hydroxyphenyl)thio]-6-(imidazol-1-ylmethyl)benzothiophene-2-carboxylic acid
Formula: C19H14N2O3S2
MolecularWeight: 382.45606
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)O)SC2=C(SC3=C2C=CC(=C3)CN4C=CN=C4)C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)O)SC2=C(SC3=C2C=CC(=C3)CN4C=CN=C4)C(=O)O


InChI

InChI=1S/C19H14N2O3S2/c22-14-3-1-2-4-15(14)25-17-13-6-5-12(10-21-8-7-20-11-21)9-16(13)26-18(17)19(23)24/h1-9,11,22H,10H2,(H,23,24)


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