4-(4-ethanoylpiperazin-1-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-N-[4-(p-tolyl)thiazol-2-yl]benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[4-(4-methylphenyl)-2-thiazolyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-3-nitro-N-[4-(p-tolyl)thiazol-2-yl]benzamide Formula: C23H23N5O4S MolecularWeight: 465.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCN(CC4)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N4CCN(CC4)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C23H23N5O4S/c1-15-3-5-17(6-4-15)19-14-33-23(24-19)25-22(30)18-7-8-20(21(13-18)28(31)32)27-11-9-26(10-12-27)16(2)29/h3-8,13-14H,9-12H2,1-2H3,(H,24,25,30)