[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxidanylidene-ethyl] 4-aminocarbonylpiperidine-1-carbodithioate

Systemtic Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxidanylidene-ethyl] 4-aminocarbonylpiperidine-1-carbodithioate Openeye Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxo-ethyl] 4-carbamoylpiperidine-1-carbodithioate CAS Name: 4-carbamoyl-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] 4-carbamoylpiperidine-1-carbodithioate Traditional Name: 4-carbamoylpiperidine-1-carbodithioic acid [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-keto-ethyl] ester Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=S)SCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=S)SCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

InChI

InChI=1S/C23H25N3O2S2/c24-22(28)18-11-13-25(14-12-18)23(29)30-15-21(27)26-19-7-3-1-5-16(19)9-10-17-6-2-4-8-20(17)26/h1-8,18H,9-15H2,(H2,24,28)