methyl N-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)-N'-prop-2-enyl-carbamimidothioate

Systemtic Name: methyl N-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)-N'-prop-2-enyl-carbamimidothioate Openeye Name: 3-allyl-1-benzyl-1-[(4-methoxyphenyl)methyl]-2-methyl-isothiourea CAS Name: N-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)-N'-prop-2-enylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-benzyl-N-[(4-methoxyphenyl)methyl]-N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-1-benzyl-2-methyl-1-p-anisyl-isothiourea Formula: C20H24N2OS MolecularWeight: 340.48236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=NCC=C)SC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=NCC=C)SC

InChI

InChI=1S/C20H24N2OS/c1-4-14-21-20(24-3)22(15-17-8-6-5-7-9-17)16-18-10-12-19(23-2)13-11-18/h4-13H,1,14-16H2,2-3H3