methyl N-(3-ethylphenyl)-N'-(1-phenylethyl)carbamimidothioate

Systemtic Name: methyl N-(3-ethylphenyl)-N'-(1-phenylethyl)carbamimidothioate Openeye Name: 1-(3-ethylphenyl)-2-methyl-3-(1-phenylethyl)isothiourea CAS Name: N-(3-ethylphenyl)-N'-(1-phenylethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(3-ethylphenyl)-N'-(1-phenylethyl)carbamimidothioate Traditional Name: 1-(3-ethylphenyl)-2-methyl-3-(1-phenylethyl)isothiourea Formula: C18H22N2S MolecularWeight: 298.44568

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=NC(C)C2=CC=CC=C2)SC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=NC(C)C2=CC=CC=C2)SC

InChI

InChI=1S/C18H22N2S/c1-4-15-9-8-12-17(13-15)20-18(21-3)19-14(2)16-10-6-5-7-11-16/h5-14H,4H2,1-3H3,(H,19,20)