[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-[1-(2-cyanoethyl)-3-indolyl]-2-oxoethyl] ester IUPAC Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-[1-(2-cyanoethyl)indol-3-yl]-2-keto-ethyl] ester Formula: C18H21N3OS2 MolecularWeight: 359.50884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)C1=CN(C2=CC=CC=C21)CCC#N

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)C1=CN(C2=CC=CC=C21)CCC#N

InChI

InChI=1S/C18H21N3OS2/c1-3-20(4-2)18(23)24-13-17(22)15-12-21(11-7-10-19)16-9-6-5-8-14(15)16/h5-6,8-9,12H,3-4,7,11,13H2,1-2H3