diphenylphosphorylmethyl N,N-bis(phenylmethyl)-N'-prop-2-enyl-carbamimidothioate

Systemtic Name: diphenylphosphorylmethyl N,N-bis(phenylmethyl)-N'-prop-2-enyl-carbamimidothioate Openeye Name: 3-allyl-1,1-dibenzyl-2-(diphenylphosphorylmethyl)isothiourea CAS Name: N,N-bis(phenylmethyl)-N'-prop-2-enylcarbamimidothioic acid diphenylphosphorylmethyl ester IUPAC Name: diphenylphosphorylmethyl N,N-dibenzyl-N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-1,1-dibenzyl-2-(diphenylphosphorylmethyl)isothiourea Formula: C31H31N2OPS MolecularWeight: 510.629401

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H31N2OPS/c1-2-23-32-31(33(24-27-15-7-3-8-16-27)25-28-17-9-4-10-18-28)36-26-35(34,29-19-11-5-12-20-29)30-21-13-6-14-22-30/h2-22H,1,23-26H2