N-(2-methyl-4-nitro-phenyl)-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2-methyl-4-nitro-phenyl)-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2-methyl-4-nitro-phenyl)-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(2-methyl-4-nitrophenyl)-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(2-methyl-4-nitrophenyl)-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: 3-(4-mesitylsulfonylpiperazino)-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)CCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)CCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C23H30N4O5S/c1-16-13-18(3)23(19(4)14-16)33(31,32)26-11-9-25(10-12-26)8-7-22(28)24-21-6-5-20(27(29)30)15-17(21)2/h5-6,13-15H,7-12H2,1-4H3,(H,24,28)