ethyl 3-[N'-ethyl-N,N-bis(phenylmethyl)carbamimidoyl]sulfanylpropanoate

Systemtic Name: ethyl 3-[N'-ethyl-N,N-bis(phenylmethyl)carbamimidoyl]sulfanylpropanoate Openeye Name: ethyl 3-(N,N-dibenzyl-N'-ethyl-carbamimidoyl)sulfanylpropanoate CAS Name: 3-[[[bis(phenylmethyl)amino]-ethyliminomethyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-(N,N-dibenzyl-N'-ethylcarbamimidoyl)sulfanylpropanoate Traditional Name: 3-[(N,N-dibenzyl-N'-ethyl-amidino)thio]propionic acid ethyl ester Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N(CC1=CC=CC=C1)CC2=CC=CC=C2)SCCC(=O)OCC

Isomeric SMILES

CCN=C(N(CC1=CC=CC=C1)CC2=CC=CC=C2)SCCC(=O)OCC

InChI

InChI=1S/C22H28N2O2S/c1-3-23-22(27-16-15-21(25)26-4-2)24(17-19-11-7-5-8-12-19)18-20-13-9-6-10-14-20/h5-14H,3-4,15-18H2,1-2H3