4-chloranyl-N-[[5-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-[4-(2-nitrophenyl)piperazin-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[4-(2-nitrophenyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[4-(2-nitrophenyl)piperazino]sulfonyl-2-thienyl]methyl]benzamide Formula: C22H21ClN4O5S2 MolecularWeight: 521.00894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN4O5S2/c23-17-7-5-16(6-8-17)22(28)24-15-18-9-10-21(33-18)34(31,32)26-13-11-25(12-14-26)19-3-1-2-4-20(19)27(29)30/h1-10H,11-15H2,(H,24,28)