zinc 1-[bis(2-diazanyl-2-oxidanylidene-ethyl)amino]-3-phenyl-thiourea dinitrite dihydrate

Systemtic Name: zinc 1-[bis(2-diazanyl-2-oxidanylidene-ethyl)amino]-3-phenyl-thiourea dinitrite dihydrate Openeye Name: zinc 1-[bis(2-hydrazino-2-oxo-ethyl)amino]-3-phenyl-thiourea dinitrite dihydrate CAS Name: zinc 1-[bis(2-hydrazinyl-2-oxoethyl)amino]-3-phenylthiourea dinitrite dihydrate IUPAC Name: zinc 1-[bis(2-hydrazinyl-2-oxoethyl)amino]-3-phenylthiourea dinitrite dihydrate Traditional Name: zinc 1-[bis(2-hydrazino-2-keto-ethyl)amino]-3-phenyl-thiourea dinitrite dihydrate Formula: C11H21N9O8SZn MolecularWeight: 504.81394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NN(CC(=O)NN)CC(=O)NN.N(=O)[O-].N(=O)[O-].O.O.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NN(CC(=O)NN)CC(=O)NN.N(=O)[O-].N(=O)[O-].O.O.[Zn+2]

InChI

InChI=1S/C11H17N7O2S.2HNO2.2H2O.Zn/c12-15-9(19)6-18(7-10(20)16-13)17-11(21)14-8-4-2-1-3-5-8;2*2-1-3;;;/h1-5H,6-7,12-13H2,(H,15,19)(H,16,20)(H2,14,17,21);2*(H,2,3);2*1H2;/q;;;;;+2/p-2