2-(4-chlorophenyl)sulfanylethyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C19H16ClNO3S MolecularWeight: 373.85324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClNO3S/c1-13-17(18(21-24-13)14-5-3-2-4-6-14)19(22)23-11-12-25-16-9-7-15(20)8-10-16/h2-10H,11-12H2,1H3