3,6-bis(chloranyl)-N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]benzothiophene-2-carboxamide Formula: C25H18Cl2N2O2S MolecularWeight: 481.39362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

InChI

InChI=1S/C25H18Cl2N2O2S/c1-3-14-5-9-20-19(10-14)29-25(31-20)15-6-4-13(2)18(11-15)28-24(30)23-22(27)17-8-7-16(26)12-21(17)32-23/h4-12H,3H2,1-2H3,(H,28,30)