[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(2-methylphenyl)methanethione

Systemtic Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(2-methylphenyl)methanethione Openeye Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(o-tolyl)methanethione CAS Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(2-methylphenyl)methanethione IUPAC Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(2-methylphenyl)methanethione Traditional Name: [5,5-bis(diethoxyphosphoryl)-2-pyrazolin-3-yl]-(o-tolyl)methanethione Formula: C19H30N2O6P2S MolecularWeight: 476.463822

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1(CC(=NN1)C(=S)C2=CC=CC=C2C)P(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C1(CC(=NN1)C(=S)C2=CC=CC=C2C)P(=O)(OCC)OCC)OCC

InChI

InChI=1S/C19H30N2O6P2S/c1-6-24-28(22,25-7-2)19(29(23,26-8-3)27-9-4)14-17(20-21-19)18(30)16-13-11-10-12-15(16)5/h10-13,21H,6-9,14H2,1-5H3