3-chloranyl-N-[2-(4-methylpiperazin-1-yl)carbonylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-methylpiperazin-1-yl)carbonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]benzothiophene-2-carboxamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H20ClN3O2S/c1-24-10-12-25(13-11-24)21(27)14-6-2-4-8-16(14)23-20(26)19-18(22)15-7-3-5-9-17(15)28-19/h2-9H,10-13H2,1H3,(H,23,26)