sodium N1',N3'-bis[(3-methoxyphenyl)carbothioyl]-N1',N3'-dimethyl-propanedihydrazide

Systemtic Name: sodium N1',N3'-bis[(3-methoxyphenyl)carbothioyl]-N1',N3'-dimethyl-propanedihydrazide Openeye Name: sodium N1',N3'-bis(3-methoxybenzenecarbothioyl)-N1',N3'-dimethyl-propanedihydrazide CAS Name: sodium N1',N3'-bis[(3-methoxyphenyl)-sulfanylidenemethyl]-N1',N3'-dimethylpropanedihydrazide IUPAC Name: sodium 1-N',3-N'-bis(3-methoxybenzenecarbothioyl)-1-N',3-N'-dimethylpropanedihydrazide Traditional Name: sodium N1',N3'-bis(3-methoxythiobenzoyl)-N1',N3'-dimethyl-malonohydrazide Formula: C42H48N8NaO8S4+ MolecularWeight: 944.12909

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)C1=CC(=CC=C1)OC)NC(=O)CC(=O)NN(C)C(=S)C2=CC(=CC=C2)OC.CN(C(=S)C1=CC(=CC=C1)OC)NC(=O)CC(=O)NN(C)C(=S)C2=CC(=CC=C2)OC.[Na+]

Isomeric SMILES

CN(C(=S)C1=CC(=CC=C1)OC)NC(=O)CC(=O)NN(C)C(=S)C2=CC(=CC=C2)OC.CN(C(=S)C1=CC(=CC=C1)OC)NC(=O)CC(=O)NN(C)C(=S)C2=CC(=CC=C2)OC.[Na+]

InChI

InChI=1S/2C21H24N4O4S2.Na/c2*1-24(20(30)14-7-5-9-16(11-14)28-3)22-18(26)13-19(27)23-25(2)21(31)15-8-6-10-17(12-15)29-4;/h2*5-12H,13H2,1-4H3,(H,22,26)(H,23,27);/q;;+1