2-(4-chlorophenyl)sulfanylethyl N'-(3,4-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl N'-(3,4-dimethylphenyl)carbamimidothioate Openeye Name: 2-[2-(4-chlorophenyl)sulfanylethyl]-3-(3,4-dimethylphenyl)isothiourea CAS Name: N'-(3,4-dimethylphenyl)carbamimidothioic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl N'-(3,4-dimethylphenyl)carbamimidothioate Traditional Name: 2-[2-[(4-chlorophenyl)thio]ethyl]-3-(3,4-dimethylphenyl)isothiourea Formula: C17H19ClN2S2 MolecularWeight: 350.92916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C(N)SCCSC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)N=C(N)SCCSC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H19ClN2S2/c1-12-3-6-15(11-13(12)2)20-17(19)22-10-9-21-16-7-4-14(18)5-8-16/h3-8,11H,9-10H2,1-2H3,(H2,19,20)