[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-[4-(dimethylamino)-3-nitro-phenyl]methanone

Systemtic Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-[4-(dimethylamino)-3-nitro-phenyl]methanone Openeye Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-[4-(dimethylamino)-3-nitro-phenyl]methanone CAS Name: [4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-[4-(dimethylamino)-3-nitrophenyl]methanone IUPAC Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-[4-(dimethylamino)-3-nitrophenyl]methanone Traditional Name: [4-(4-tert-butylphenyl)sulfonylpiperazino]-[4-(dimethylamino)-3-nitro-phenyl]methanone Formula: C23H30N4O5S MolecularWeight: 474.5731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O5S/c1-23(2,3)18-7-9-19(10-8-18)33(31,32)26-14-12-25(13-15-26)22(28)17-6-11-20(24(4)5)21(16-17)27(29)30/h6-11,16H,12-15H2,1-5H3