2-(3-methylphenoxy)ethyl N'-(2,6-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(3-methylphenoxy)ethyl N'-(2,6-dimethylphenyl)carbamimidothioate Openeye Name: 3-(2,6-dimethylphenyl)-2-[2-(3-methylphenoxy)ethyl]isothiourea CAS Name: N'-(2,6-dimethylphenyl)carbamimidothioic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl N'-(2,6-dimethylphenyl)carbamimidothioate Traditional Name: 3-(2,6-dimethylphenyl)-2-[2-(3-methylphenoxy)ethyl]isothiourea Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC(=NC2=C(C=CC=C2C)C)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC(=NC2=C(C=CC=C2C)C)N

InChI

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