2-(3-methylphenoxy)ethylcarbamothioylsulfanyl N-[2-(3-methylphenoxy)ethyl]carbamodithioate

Systemtic Name: 2-(3-methylphenoxy)ethylcarbamothioylsulfanyl N-[2-(3-methylphenoxy)ethyl]carbamodithioate Openeye Name: 2-(3-methylphenoxy)ethylcarbamothioylsulfanyl N-[2-(3-methylphenoxy)ethyl]carbamodithioate CAS Name: N-[2-(3-methylphenoxy)ethyl]carbamodithioic acid [[[2-(3-methylphenoxy)ethylamino]-sulfanylidenemethyl]thio] ester IUPAC Name: 2-(3-methylphenoxy)ethylcarbamothioylsulfanyl N-[2-(3-methylphenoxy)ethyl]carbamodithioate Traditional Name: N-[2-(3-methylphenoxy)ethyl]carbamodithioic acid [2-(3-methylphenoxy)ethylthiocarbamoylthio] ester Formula: C20H24N2O2S4 MolecularWeight: 452.67676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=S)SSC(=S)NCCOC2=CC=CC(=C2)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=S)SSC(=S)NCCOC2=CC=CC(=C2)C

InChI

InChI=1S/C20H24N2O2S4/c1-15-5-3-7-17(13-15)23-11-9-21-19(25)27-28-20(26)22-10-12-24-18-8-4-6-16(2)14-18/h3-8,13-14H,9-12H2,1-2H3,(H,21,25)(H,22,26)