S-[3-diphenoxyphosphoryl-3-(phenylcarbamothioylamino)propyl] ethanethioate

Systemtic Name: S-[3-diphenoxyphosphoryl-3-(phenylcarbamothioylamino)propyl] ethanethioate Openeye Name: S-[3-diphenoxyphosphoryl-3-(phenylcarbamothioylamino)propyl] ethanethioate CAS Name: ethanethioic acid S-[3-[[anilino(sulfanylidene)methyl]amino]-3-diphenoxyphosphorylpropyl] ester IUPAC Name: S-[3-diphenoxyphosphoryl-3-(phenylcarbamothioylamino)propyl] ethanethioate Traditional Name: ethanethioic acid S-[3-diphenoxyphosphoryl-3-(phenylthiocarbamoylamino)propyl] ester Formula: C24H25N2O4PS2 MolecularWeight: 500.570061

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(NC(=S)NC1=CC=CC=C1)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)SCCC(NC(=S)NC1=CC=CC=C1)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C24H25N2O4PS2/c1-19(27)33-18-17-23(26-24(32)25-20-11-5-2-6-12-20)31(28,29-21-13-7-3-8-14-21)30-22-15-9-4-10-16-22/h2-16,23H,17-18H2,1H3,(H2,25,26,32)