[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxidanylidene-ethyl] 2-ethylpiperidine-1-carbodithioate

Systemtic Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxidanylidene-ethyl] 2-ethylpiperidine-1-carbodithioate Openeye Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxo-ethyl] 2-ethylpiperidine-1-carbodithioate CAS Name: 2-ethyl-1-piperidinecarbodithioic acid [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl] ester IUPAC Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl] 2-ethylpiperidine-1-carbodithioate Traditional Name: 2-ethylpiperidine-1-carbodithioic acid [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-keto-ethyl] ester Formula: C24H28N2OS2 MolecularWeight: 424.62192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=S)SCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

Isomeric SMILES

CCC1CCCCN1C(=S)SCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

InChI

InChI=1S/C24H28N2OS2/c1-2-20-11-7-8-16-25(20)24(28)29-17-23(27)26-21-12-5-3-9-18(21)14-15-19-10-4-6-13-22(19)26/h3-6,9-10,12-13,20H,2,7-8,11,14-17H2,1H3