S-(4-methylphenyl) 5-(4-chlorophenyl)-1,2-oxazole-3-carbothioate

Systemtic Name: S-(4-methylphenyl) 5-(4-chlorophenyl)-1,2-oxazole-3-carbothioate Openeye Name: S-(p-tolyl) 5-(4-chlorophenyl)isoxazole-3-carbothioate CAS Name: 5-(4-chlorophenyl)-3-isoxazolecarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 5-(4-chlorophenyl)-1,2-oxazole-3-carbothioate Traditional Name: 5-(4-chlorophenyl)isoxazole-3-carbothioic acid S-(p-tolyl) ester Formula: C17H12ClNO2S MolecularWeight: 329.80068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C2=NOC(=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C2=NOC(=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClNO2S/c1-11-2-8-14(9-3-11)22-17(20)15-10-16(21-19-15)12-4-6-13(18)7-5-12/h2-10H,1H3