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

Systemtic Name: S-(4-chlorophenyl) 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carbothioate Openeye Name: S-(4-chlorophenyl) 5-(3,4-dimethylphenyl)isoxazole-3-carbothioate CAS Name: 5-(3,4-dimethylphenyl)-3-isoxazolecarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carbothioate Traditional Name: 5-(3,4-dimethylphenyl)isoxazole-3-carbothioic acid S-(4-chlorophenyl) ester Formula: C18H14ClNO2S MolecularWeight: 343.82726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)SC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)SC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H14ClNO2S/c1-11-3-4-13(9-12(11)2)17-10-16(20-22-17)18(21)23-15-7-5-14(19)6-8-15/h3-10H,1-2H3