3-chloranyl-N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-[4-(4-ethylbenzoyl)piperazino]phenyl]benzothiophene-2-carboxamide Formula: C28H26ClN3O2S MolecularWeight: 504.04294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C28H26ClN3O2S/c1-2-19-7-9-20(10-8-19)28(34)32-17-15-31(16-18-32)22-13-11-21(12-14-22)30-27(33)26-25(29)23-5-3-4-6-24(23)35-26/h3-14H,2,15-18H2,1H3,(H,30,33)