methyl 4-[[2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]phenyl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoyl]amino]benzoate CAS Name: 4-[[[2-[[(4-methyl-2-thiazolyl)thio]methyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoyl]amino]benzoate Traditional Name: 4-[[2-[[(4-methylthiazol-2-yl)thio]methyl]benzoyl]amino]benzoic acid methyl ester Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H18N2O3S2/c1-13-11-26-20(21-13)27-12-15-5-3-4-6-17(15)18(23)22-16-9-7-14(8-10-16)19(24)25-2/h3-11H,12H2,1-2H3,(H,22,23)