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

Systemtic Name: butyl N,N-bis(phenylmethyl)-N'-prop-2-enyl-carbamimidothioate Openeye Name: 3-allyl-1,1-dibenzyl-2-butyl-isothiourea CAS Name: N,N-bis(phenylmethyl)-N'-prop-2-enylcarbamimidothioic acid butyl ester IUPAC Name: butyl N,N-dibenzyl-N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-1,1-dibenzyl-2-butyl-isothiourea Formula: C22H28N2S MolecularWeight: 352.53612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=NCC=C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

CCCCSC(=NCC=C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C22H28N2S/c1-3-5-17-25-22(23-16-4-2)24(18-20-12-8-6-9-13-20)19-21-14-10-7-11-15-21/h4,6-15H,2-3,5,16-19H2,1H3