(4-phenylphenyl)methyl N'-(3-methoxyphenyl)carbamimidothioate

Systemtic Name: (4-phenylphenyl)methyl N'-(3-methoxyphenyl)carbamimidothioate Openeye Name: 3-(3-methoxyphenyl)-2-[(4-phenylphenyl)methyl]isothiourea CAS Name: N'-(3-methoxyphenyl)carbamimidothioic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl N'-(3-methoxyphenyl)carbamimidothioate Traditional Name: 3-(3-methoxyphenyl)-2-(4-phenylbenzyl)isothiourea Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N=C(N)SCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)N=C(N)SCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2OS/c1-24-20-9-5-8-19(14-20)23-21(22)25-15-16-10-12-18(13-11-16)17-6-3-2-4-7-17/h2-14H,15H2,1H3,(H2,22,23)