3-chloranyl-N-[2-methoxy-5-(2-oxidanylidenechromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-methoxy-5-(2-oxidanylidenechromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-methoxy-5-(2-oxochromen-3-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-methoxy-5-(2-oxo-1-benzopyran-3-yl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-methoxy-5-(2-oxochromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[5-(2-ketochromen-3-yl)-2-methoxy-phenyl]benzothiophene-2-carboxamide Formula: C25H16ClNO4S MolecularWeight: 461.91684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C25H16ClNO4S/c1-30-20-11-10-14(17-12-15-6-2-4-8-19(15)31-25(17)29)13-18(20)27-24(28)23-22(26)16-7-3-5-9-21(16)32-23/h2-13H,1H3,(H,27,28)