(2R)-2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxylate

Systemtic Name: (2R)-2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxylate Openeye Name: (2R)-2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylate CAS Name: (2R)-2-[[(2-chlorophenyl)methylthio]methyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylate IUPAC Name: (2R)-2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylate Traditional Name: (2R)-2-[[(2-chlorobenzyl)thio]methyl]-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxylate Formula: C17H14ClN2O3S- MolecularWeight: 361.82266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC[C@H]2C(=O)NC3=C(N2)C=CC(=C3)C(=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O3S/c18-12-4-2-1-3-11(12)8-24-9-15-16(21)20-14-7-10(17(22)23)5-6-13(14)19-15/h1-7,15,19H,8-9H2,(H,20,21)(H,22,23)/p-1/t15-/m0/s1