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

Systemtic Name: 3,6-bis(chloranyl)-N-[3-methoxy-4-(2-oxidanylidenechromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[3-methoxy-4-(2-oxochromen-3-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[3-methoxy-4-(2-oxo-1-benzopyran-3-yl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[3-methoxy-4-(2-oxochromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[4-(2-ketochromen-3-yl)-3-methoxy-phenyl]benzothiophene-2-carboxamide Formula: C25H15Cl2NO4S MolecularWeight: 496.3619

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H15Cl2NO4S/c1-31-20-12-15(28-24(29)23-22(27)17-8-6-14(26)11-21(17)33-23)7-9-16(20)18-10-13-4-2-3-5-19(13)32-25(18)30/h2-12H,1H3,(H,28,29)