1-(3-methyl-5-nitro-imidazol-4-yl)-4-(phenylmethyl)sulfonyl-piperazine

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(phenylmethyl)sulfonyl-piperazine Openeye Name: 1-benzylsulfonyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazine CAS Name: 1-(3-methyl-5-nitro-4-imidazolyl)-4-(phenylmethyl)sulfonylpiperazine IUPAC Name: 1-benzylsulfonyl-4-(3-methyl-5-nitroimidazol-4-yl)piperazine Traditional Name: 1-benzylsulfonyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazine Formula: C15H19N5O4S MolecularWeight: 365.40746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O4S/c1-17-12-16-14(20(21)22)15(17)18-7-9-19(10-8-18)25(23,24)11-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3