zinc [4-[(2-methylphenyl)sulfonylcarbamoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: zinc [4-[(2-methylphenyl)sulfonylcarbamoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: zinc [4-(o-tolylsulfonylcarbamoylamino)phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: zinc [4-[[[(2-methylphenyl)sulfonylamino]-oxomethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: zinc [4-[(2-methylphenyl)sulfonylcarbamoylamino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: zinc [4-(o-tolylsulfonylcarbamoylamino)phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C36H32N10O10S4Zn MolecularWeight: 958.36928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3.CC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3.[Zn+2]

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3.CC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3.[Zn+2]

InChI

InChI=1S/2C18H17N5O5S2.Zn/c2*1-13-5-2-3-6-16(13)30(27,28)23-18(24)21-14-7-9-15(10-8-14)29(25,26)22-17-19-11-4-12-20-17;/h2*2-12H,1H3,(H3,19,20,21,22,23,24);/q;;+2/p-2