(3-thiocyanato-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl) thiocyanate

Systemtic Name: (3-thiocyanato-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl) thiocyanate Openeye Name: (3-thiocyanato-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl) thiocyanate CAS Name: thiocyanic acid (3-thiocyanato-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl) ester IUPAC Name: (3-thiocyanato-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl) thiocyanate Traditional Name: thiocyanic acid (3-thiocyanato-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl) ester Formula: C16H11N3S2 MolecularWeight: 309.40864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)SC#N)NC3=C1C=C(C=C3)SC#N

Isomeric SMILES

C1CC2=C(C=CC(=C2)SC#N)NC3=C1C=C(C=C3)SC#N

InChI

InChI=1S/C16H11N3S2/c17-9-20-13-3-5-15-11(7-13)1-2-12-8-14(21-10-18)4-6-16(12)19-15/h3-8,19H,1-2H2