diphenylphosphorylmethyl N'-ethyl-N,N-bis(phenylmethyl)carbamimidothioate

Systemtic Name: diphenylphosphorylmethyl N'-ethyl-N,N-bis(phenylmethyl)carbamimidothioate Openeye Name: 1,1-dibenzyl-2-(diphenylphosphorylmethyl)-3-ethyl-isothiourea CAS Name: N'-ethyl-N,N-bis(phenylmethyl)carbamimidothioic acid diphenylphosphorylmethyl ester IUPAC Name: diphenylphosphorylmethyl N,N-dibenzyl-N'-ethylcarbamimidothioate Traditional Name: 1,1-dibenzyl-2-(diphenylphosphorylmethyl)-3-ethyl-isothiourea Formula: C30H31N2OPS MolecularWeight: 498.618701

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N(CC1=CC=CC=C1)CC2=CC=CC=C2)SCP(=O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN=C(N(CC1=CC=CC=C1)CC2=CC=CC=C2)SCP(=O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H31N2OPS/c1-2-31-30(32(23-26-15-7-3-8-16-26)24-27-17-9-4-10-18-27)35-25-34(33,28-19-11-5-12-20-28)29-21-13-6-14-22-29/h3-22H,2,23-25H2,1H3