2-[N'-(2-methoxyphenyl)carbamimidoyl]sulfanylethyl N'-(2-methoxyphenyl)carbamimidothioate

Systemtic Name: 2-[N'-(2-methoxyphenyl)carbamimidoyl]sulfanylethyl N'-(2-methoxyphenyl)carbamimidothioate Openeye Name: 3-(2-methoxyphenyl)-2-[2-[N'-(2-methoxyphenyl)carbamimidoyl]sulfanylethyl]isothiourea CAS Name: N'-(2-methoxyphenyl)carbamimidothioic acid 2-[[amino-(2-methoxyphenyl)iminomethyl]thio]ethyl ester IUPAC Name: 2-[N'-(2-methoxyphenyl)carbamimidoyl]sulfanylethyl N'-(2-methoxyphenyl)carbamimidothioate Traditional Name: 3-(2-methoxyphenyl)-2-[2-[[N'-(2-methoxyphenyl)amidino]thio]ethyl]isothiourea Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N=C(N)SCCSC(=NC2=CC=CC=C2OC)N

Isomeric SMILES

COC1=CC=CC=C1N=C(N)SCCSC(=NC2=CC=CC=C2OC)N

InChI

InChI=1S/C18H22N4O2S2/c1-23-15-9-5-3-7-13(15)21-17(19)25-11-12-26-18(20)22-14-8-4-6-10-16(14)24-2/h3-10H,11-12H2,1-2H3,(H2,19,21)(H2,20,22)