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

Systemtic Name: 2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-1-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-1-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-1-(3,4,5-trimethoxyphenyl)ethanone Formula: C18H16ClNO5S MolecularWeight: 393.84134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CSC2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CSC2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C18H16ClNO5S/c1-22-15-6-10(7-16(23-2)17(15)24-3)13(21)9-26-18-20-12-8-11(19)4-5-14(12)25-18/h4-8H,9H2,1-3H3