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

Systemtic Name: 2-methyl-3-nitro-N-[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]benzamide Openeye Name: 2-methyl-3-nitro-N-[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]benzamide CAS Name: 2-methyl-3-nitro-N-[4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 2-methyl-3-nitro-N-[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 2-methyl-3-nitro-N-[4-[4-(2-thenoyl)piperazino]phenyl]benzamide Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H22N4O4S/c1-16-19(4-2-5-20(16)27(30)31)22(28)24-17-7-9-18(10-8-17)25-11-13-26(14-12-25)23(29)21-6-3-15-32-21/h2-10,15H,11-14H2,1H3,(H,24,28)