N-(2-methyl-3-nitro-phenyl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-(2-methyl-3-nitro-phenyl)-2-[4-(2-thenoyl)piperazino]acetamide Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H20N4O4S/c1-13-14(4-2-5-15(13)22(25)26)19-17(23)12-20-7-9-21(10-8-20)18(24)16-6-3-11-27-16/h2-6,11H,7-10,12H2,1H3,(H,19,23)