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

Systemtic Name: [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxidanylidene-propyl] 3,5-dimethylpiperidine-1-carbodithioate Openeye Name: [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-oxo-propyl] 3,5-dimethylpiperidine-1-carbodithioate CAS Name: 3,5-dimethyl-1-piperidinecarbodithioic 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] 3,5-dimethylpiperidine-1-carbodithioate Traditional Name: 3,5-dimethylpiperidine-1-carbodithioic acid [3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-keto-propyl] ester Formula: C25H30N2OS2 MolecularWeight: 438.6485

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=S)SCCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42)C

Isomeric SMILES

CC1CC(CN(C1)C(=S)SCCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42)C

InChI

InChI=1S/C25H30N2OS2/c1-18-15-19(2)17-26(16-18)25(29)30-14-13-24(28)27-22-9-5-3-7-20(22)11-12-21-8-4-6-10-23(21)27/h3-10,18-19H,11-17H2,1-2H3