2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)ethanone

Systemtic Name: 2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)ethanone Openeye Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)ethanone CAS Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-1-(3,4-dimethylphenyl)ethanone IUPAC Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)ethanone Traditional Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-1-(3,4-dimethylphenyl)ethanone Formula: C17H14ClNO2S MolecularWeight: 331.81656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NC3=C(O2)C=CC(=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NC3=C(O2)C=CC(=C3)Cl)C

InChI

InChI=1S/C17H14ClNO2S/c1-10-3-4-12(7-11(10)2)15(20)9-22-17-19-14-8-13(18)5-6-16(14)21-17/h3-8H,9H2,1-2H3