[2-oxidanylidene-2-[2,2,4-trimethyl-6-(triphenylmethyl)quinolin-1-yl]ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-oxidanylidene-2-[2,2,4-trimethyl-6-(triphenylmethyl)quinolin-1-yl]ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-oxo-2-(2,2,4-trimethyl-6-trityl-1-quinolyl)ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-oxo-2-[2,2,4-trimethyl-6-(triphenylmethyl)-1-quinolinyl]ethyl] ester IUPAC Name: [2-oxo-2-(2,2,4-trimethyl-6-tritylquinolin-1-yl)ethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-keto-2-(2,2,4-trimethyl-6-trityl-1-quinolyl)ethyl] ester Formula: C38H40N2OS2 MolecularWeight: 604.867

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)N1C2=C(C=C(C=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=CC1(C)C)C

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)N1C2=C(C=C(C=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=CC1(C)C)C

InChI

InChI=1S/C38H40N2OS2/c1-6-39(7-2)36(42)43-27-35(41)40-34-24-23-32(25-33(34)28(3)26-37(40,4)5)38(29-17-11-8-12-18-29,30-19-13-9-14-20-30)31-21-15-10-16-22-31/h8-26H,6-7,27H2,1-5H3