methyl N,N'-bis(4-ethoxyphenyl)carbamimidothioate

Systemtic Name: methyl N,N'-bis(4-ethoxyphenyl)carbamimidothioate Openeye Name: 1,3-bis(4-ethoxyphenyl)-2-methyl-isothiourea CAS Name: N,N'-bis(4-ethoxyphenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N,N'-bis(4-ethoxyphenyl)carbamimidothioate Traditional Name: 2-methyl-1,3-bis(p-phenetyl)isothiourea Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OCC)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OCC)SC

InChI

InChI=1S/C18H22N2O2S/c1-4-21-16-10-6-14(7-11-16)19-18(23-3)20-15-8-12-17(13-9-15)22-5-2/h6-13H,4-5H2,1-3H3,(H,19,20)