N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-4-nitro-benzamide Openeye Name: N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-4-nitro-benzamide CAS Name: N-[3-chloro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-4-nitrobenzamide Traditional Name: N-[3-chloro-4-[4-(2-thenoyl)piperazino]phenyl]-4-nitro-benzamide Formula: C22H19ClN4O4S MolecularWeight: 470.92866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H19ClN4O4S/c23-18-14-16(24-21(28)15-3-6-17(7-4-15)27(30)31)5-8-19(18)25-9-11-26(12-10-25)22(29)20-2-1-13-32-20/h1-8,13-14H,9-12H2,(H,24,28)