2-[[2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methylsulfanyl]benzoate

Systemtic Name: 2-[[2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methylsulfanyl]benzoate Openeye Name: 2-[[2-[2-(2-methylanilino)-2-oxo-ethyl]thiazol-4-yl]methylsulfanyl]benzoate CAS Name: 2-[[2-[2-(2-methylanilino)-2-oxoethyl]-4-thiazolyl]methylthio]benzoate IUPAC Name: 2-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methylsulfanyl]benzoate Traditional Name: 2-[[2-[2-keto-2-(o-toluidino)ethyl]thiazol-4-yl]methylthio]benzoate Formula: C20H17N2O3S2- MolecularWeight: 397.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)CSC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)CSC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C20H18N2O3S2/c1-13-6-2-4-8-16(13)22-18(23)10-19-21-14(12-27-19)11-26-17-9-5-3-7-15(17)20(24)25/h2-9,12H,10-11H2,1H3,(H,22,23)(H,24,25)/p-1