2-[3-(2,4-dimethylphenyl)-5-methyl-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl 2,2-dimethylpropanoate

Systemtic Name: 2-[3-(2,4-dimethylphenyl)-5-methyl-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl 2,2-dimethylpropanoate Openeye Name: 2-[3-(2,4-dimethylphenyl)-5-methyl-4-thioxo-1,3,5-triazinan-1-yl]ethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 2-[3-(2,4-dimethylphenyl)-5-methyl-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl ester IUPAC Name: 2-[3-(2,4-dimethylphenyl)-5-methyl-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 2-[3-(2,4-dimethylphenyl)-5-methyl-4-thioxo-1,3,5-triazinan-1-yl]ethyl ester Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CN(CN(C2=S)C)CCOC(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CN(CN(C2=S)C)CCOC(=O)C(C)(C)C)C

InChI

InChI=1S/C19H29N3O2S/c1-14-7-8-16(15(2)11-14)22-13-21(12-20(6)18(22)25)9-10-24-17(23)19(3,4)5/h7-8,11H,9-10,12-13H2,1-6H3