1-(3-methyl-5-nitro-imidazol-4-yl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine Openeye Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine CAS Name: 1-(3-methyl-5-nitro-4-imidazolyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine IUPAC Name: 1-(3-methyl-5-nitroimidazol-4-yl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine Traditional Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine Formula: C19H27N5O4S MolecularWeight: 421.51378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C3=C(N=CN3C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C3=C(N=CN3C)[N+](=O)[O-])C)C

InChI

InChI=1S/C19H27N5O4S/c1-12-13(2)15(4)17(16(5)14(12)3)29(27,28)23-9-7-22(8-10-23)19-18(24(25)26)20-11-21(19)6/h11H,7-10H2,1-6H3