3,6-bis(chloranyl)-N-[4-(4-ethylpiperazin-1-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[4-(4-ethylpiperazin-1-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[4-(4-ethylpiperazin-1-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[4-(4-ethyl-1-piperazinyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[4-(4-ethylpiperazin-1-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[4-(4-ethylpiperazino)phenyl]benzothiophene-2-carboxamide Formula: C21H21Cl2N3OS MolecularWeight: 434.38194

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3OS/c1-2-25-9-11-26(12-10-25)16-6-4-15(5-7-16)24-21(27)20-19(23)17-8-3-14(22)13-18(17)28-20/h3-8,13H,2,9-12H2,1H3,(H,24,27)