zinc (Z)-1-(4-bromophenyl)-3-[4-(4,6-dimethylpyrimidin-2-yl)azanidylsulfonylphenyl]imino-prop-1-en-1-olate

Systemtic Name: zinc (Z)-1-(4-bromophenyl)-3-[4-(4,6-dimethylpyrimidin-2-yl)azanidylsulfonylphenyl]imino-prop-1-en-1-olate Openeye Name: zinc (Z)-1-(4-bromophenyl)-3-[4-(4,6-dimethylpyrimidin-2-yl)azanidylsulfonylphenyl]imino-prop-1-en-1-olate CAS Name: zinc (Z)-1-(4-bromophenyl)-3-[4-[(4,6-dimethyl-2-pyrimidinyl)azanidylsulfonyl]phenyl]imino-1-propen-1-olate IUPAC Name: zinc (Z)-1-(4-bromophenyl)-3-[4-(4,6-dimethylpyrimidin-2-yl)azanidylsulfonylphenyl]iminoprop-1-en-1-olate Traditional Name: zinc (Z)-1-(4-bromophenyl)-3-[4-(4,6-dimethylpyrimidin-2-yl)azanidylsulfonylphenyl]imino-prop-1-en-1-olate Formula: C21H17BrN4O3SZn MolecularWeight: 550.76268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)[N-]S(=O)(=O)C2=CC=C(C=C2)N=CC=C(C3=CC=C(C=C3)Br)[O-])C.[Zn+2]

Isomeric SMILES

CC1=CC(=NC(=N1)[N-]S(=O)(=O)C2=CC=C(C=C2)N=C/C=C(/C3=CC=C(C=C3)Br)\[O-])C.[Zn+2]

InChI

InChI=1S/C21H18BrN4O3S.Zn/c1-14-13-15(2)25-21(24-14)26-30(28,29)19-9-7-18(8-10-19)23-12-11-20(27)16-3-5-17(22)6-4-16;/h3-13H,1-2H3,(H-,23,24,25,26,27);/q-1;+2/p-1