2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide

Systemtic Name: 2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide IUPAC Name: 2-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]acetamide Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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