2-[[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid

Systemtic Name: 2-[[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid Openeye Name: 2-[[4-(1H-indol-3-yl)thiazol-2-yl]methylsulfanyl]benzoic acid CAS Name: 2-[[4-(1H-indol-3-yl)-2-thiazolyl]methylthio]benzoic acid IUPAC Name: 2-[[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid Traditional Name: 2-[[4-(1H-indol-3-yl)thiazol-2-yl]methylthio]benzoic acid Formula: C19H14N2O2S2 MolecularWeight: 366.45666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)CSC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=CSC(=N3)CSC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C19H14N2O2S2/c22-19(23)13-6-2-4-8-17(13)24-11-18-21-16(10-25-18)14-9-20-15-7-3-1-5-12(14)15/h1-10,20H,11H2,(H,22,23)