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

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-3-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-3-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]propanamide CAS Name: N-(2-methyl-5-nitrophenyl)-3-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-3-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-3-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]propionamide Formula: C19H24N4O5S2 MolecularWeight: 452.54766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C

InChI

InChI=1S/C19H24N4O5S2/c1-14-3-5-16(23(25)26)13-17(14)20-18(24)7-8-21-9-11-22(12-10-21)30(27,28)19-6-4-15(2)29-19/h3-6,13H,7-12H2,1-2H3,(H,20,24)