methyl 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzoate

Systemtic Name: methyl 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzoate Openeye Name: methyl 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzoate CAS Name: 2-[(3-methyl-2-quinoxalinyl)methylthio]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3-methylquinoxalin-2-yl)methylthio]benzoic acid methyl ester Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H16N2O2S/c1-12-16(20-15-9-5-4-8-14(15)19-12)11-23-17-10-6-3-7-13(17)18(21)22-2/h3-10H,11H2,1-2H3