N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C23H13BrCl2N2O3S MolecularWeight: 548.23592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl)Br

InChI

InChI=1S/C23H13BrCl2N2O3S/c1-30-17-6-2-11(8-15(17)24)23-28-16-10-13(4-7-18(16)31-23)27-22(29)21-20(26)14-5-3-12(25)9-19(14)32-21/h2-10H,1H3,(H,27,29)