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

Systemtic Name: 3-chloranyl-N-[2-(4-ethylpiperazin-1-yl)phenyl]-4-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-ethylpiperazin-1-yl)phenyl]-4-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(4-ethyl-1-piperazinyl)phenyl]-4-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-ethylpiperazin-1-yl)phenyl]-4-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(4-ethylpiperazino)phenyl]-4-methyl-benzothiophene-2-carboxamide Formula: C22H24ClN3OS MolecularWeight: 413.96346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C4=C(C=CC=C4S3)C)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C4=C(C=CC=C4S3)C)Cl

InChI

InChI=1S/C22H24ClN3OS/c1-3-25-11-13-26(14-12-25)17-9-5-4-8-16(17)24-22(27)21-20(23)19-15(2)7-6-10-18(19)28-21/h4-10H,3,11-14H2,1-2H3,(H,24,27)