N-(4-methyl-3-nitro-phenyl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]acetamide CAS Name: N-(4-methyl-3-nitrophenyl)-2-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]acetamide Formula: C18H22N4O5S2 MolecularWeight: 438.52108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S2/c1-13-3-5-15(11-16(13)22(24)25)19-17(23)12-20-7-9-21(10-8-20)29(26,27)18-6-4-14(2)28-18/h3-6,11H,7-10,12H2,1-2H3,(H,19,23)