3-chloranyl-N-[5-chloranyl-2-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[5-chloranyl-2-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[5-chloro-2-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazino]phenyl]-7-nitro-benzothiophene-2-carboxamide Formula: C26H19Cl2FN4O4S MolecularWeight: 573.422863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl)C(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C4=C(S3)C(=CC=C4)[N+](=O)[O-])Cl)C(=O)C5=CC=CC=C5F

InChI

InChI=1S/C26H19Cl2FN4O4S/c27-15-8-9-20(31-10-12-32(13-11-31)26(35)16-4-1-2-6-18(16)29)19(14-15)30-25(34)24-22(28)17-5-3-7-21(33(36)37)23(17)38-24/h1-9,14H,10-13H2,(H,30,34)