[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxidanylidene-propyl] 4-ethylpiperazine-1-carbodithioate

Systemtic Name: [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxidanylidene-propyl] 4-ethylpiperazine-1-carbodithioate Openeye Name: [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxo-propyl] 4-ethylpiperazine-1-carbodithioate CAS Name: 4-ethyl-1-piperazinecarbodithioic acid [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxopropyl] ester IUPAC Name: [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxopropyl] 4-ethylpiperazine-1-carbodithioate Traditional Name: 4-ethylpiperazine-1-carbodithioic acid [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-keto-propyl] ester Formula: C24H29N3OS2 MolecularWeight: 439.63656

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=S)SCCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

Isomeric SMILES

CCN1CCN(CC1)C(=S)SCCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

InChI

InChI=1S/C24H29N3OS2/c1-2-25-14-16-26(17-15-25)24(29)30-18-13-23(28)27-21-9-5-3-7-19(21)11-12-20-8-4-6-10-22(20)27/h3-10H,2,11-18H2,1H3