methyl N,N'-bis(2-ethylphenyl)carbamimidothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=NC2=CC=CC=C2CC)SC

Isomeric SMILES

CCC1=CC=CC=C1NC(=NC2=CC=CC=C2CC)SC

InChI

InChI=1S/C18H22N2S/c1-4-14-10-6-8-12-16(14)19-18(21-3)20-17-13-9-7-11-15(17)5-2/h6-13H,4-5H2,1-3H3,(H,19,20)