2-(2-methylphenoxy)ethyl N'-(2,5-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(2-methylphenoxy)ethyl N'-(2,5-dimethylphenyl)carbamimidothioate Openeye Name: 3-(2,5-dimethylphenyl)-2-[2-(2-methylphenoxy)ethyl]isothiourea CAS Name: N'-(2,5-dimethylphenyl)carbamimidothioic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl N'-(2,5-dimethylphenyl)carbamimidothioate Traditional Name: 3-(2,5-dimethylphenyl)-2-[2-(2-methylphenoxy)ethyl]isothiourea Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N=C(N)SCCOC2=CC=CC=C2C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N=C(N)SCCOC2=CC=CC=C2C

InChI

InChI=1S/C18H22N2OS/c1-13-8-9-14(2)16(12-13)20-18(19)22-11-10-21-17-7-5-4-6-15(17)3/h4-9,12H,10-11H2,1-3H3,(H2,19,20)