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

Systemtic Name: 2-[[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoate Openeye Name: 2-[[4-(1H-indol-3-yl)thiazol-2-yl]methylsulfanyl]benzoate CAS Name: 2-[[4-(1H-indol-3-yl)-2-thiazolyl]methylthio]benzoate IUPAC Name: 2-[[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoate Traditional Name: 2-[[4-(1H-indol-3-yl)thiazol-2-yl]methylthio]benzoate Formula: C19H13N2O2S2- MolecularWeight: 365.44872

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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)/p-1