1-(3-methyl-5-nitro-imidazol-4-yl)-4-[(E)-2-phenylethenyl]sulfonyl-piperazine

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-[(E)-2-phenylethenyl]sulfonyl-piperazine Openeye Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-[(E)-styryl]sulfonyl-piperazine CAS Name: 1-(3-methyl-5-nitro-4-imidazolyl)-4-[(E)-2-phenylethenyl]sulfonylpiperazine IUPAC Name: 1-(3-methyl-5-nitroimidazol-4-yl)-4-[(E)-2-phenylethenyl]sulfonylpiperazine Traditional Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-[(E)-styryl]sulfonyl-piperazine Formula: C16H19N5O4S MolecularWeight: 377.41816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5O4S/c1-18-13-17-15(21(22)23)16(18)19-8-10-20(11-9-19)26(24,25)12-7-14-5-3-2-4-6-14/h2-7,12-13H,8-11H2,1H3/b12-7+