3-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]-4-methyl-benzoate

Systemtic Name: 3-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]-4-methyl-benzoate Openeye Name: 3-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]-4-methyl-benzoate CAS Name: 3-[[[2-[(2-cyanophenyl)thio]phenyl]-oxomethyl]amino]-4-methylbenzoate IUPAC Name: 3-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(2-cyanophenyl)thio]benzoyl]amino]-4-methyl-benzoate Formula: C22H15N2O3S- MolecularWeight: 387.4311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C22H16N2O3S/c1-14-10-11-15(22(26)27)12-18(14)24-21(25)17-7-3-5-9-20(17)28-19-8-4-2-6-16(19)13-23/h2-12H,1H3,(H,24,25)(H,26,27)/p-1