3-chloranyl-N-[3-methyl-4-(2-oxidanylidenechromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-methyl-4-(2-oxidanylidenechromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-methyl-4-(2-oxochromen-3-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-methyl-4-(2-oxo-1-benzopyran-3-yl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-methyl-4-(2-oxochromen-3-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(2-ketochromen-3-yl)-3-methyl-phenyl]benzothiophene-2-carboxamide Formula: C25H16ClNO3S MolecularWeight: 445.91744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H16ClNO3S/c1-14-12-16(27-24(28)23-22(26)18-7-3-5-9-21(18)31-23)10-11-17(14)19-13-15-6-2-4-8-20(15)30-25(19)29/h2-13H,1H3,(H,27,28)