3-chloranyl-N-[3-methoxy-4-(pentanoylamino)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-methoxy-4-(pentanoylamino)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-methoxy-4-(pentanoylamino)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-methoxy-4-(1-oxopentylamino)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-methoxy-4-(pentanoylamino)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3-methoxy-4-(valerylamino)phenyl]benzothiophene-2-carboxamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)OC

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)OC

InChI

InChI=1S/C21H21ClN2O3S/c1-3-4-9-18(25)24-15-11-10-13(12-16(15)27-2)23-21(26)20-19(22)14-7-5-6-8-17(14)28-20/h5-8,10-12H,3-4,9H2,1-2H3,(H,23,26)(H,24,25)