6-oxidanylidene-7,8-dihydro-5H-benzo[b][1]benzothiepine-9-carbonitrile

Systemtic Name: 6-oxidanylidene-7,8-dihydro-5H-benzo[b][1]benzothiepine-9-carbonitrile Openeye Name: 6-oxo-7,8-dihydro-5H-benzo[b][1]benzothiepine-9-carbonitrile CAS Name: 6-oxo-7,8-dihydro-5H-benzo[b][1]benzothiepin-9-carbonitrile IUPAC Name: 6-oxo-7,8-dihydro-5H-benzo[b][1]benzothiepine-9-carbonitrile Traditional Name: 6-keto-7,8-dihydro-5H-benzo[b][1]benzothiepin-9-carbonitrile Formula: C15H11NOS MolecularWeight: 253.31894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1C#N)SC3=CC=CC=C3CC2=O

Isomeric SMILES

C1CC2=C(C=C1C#N)SC3=CC=CC=C3CC2=O

InChI

InChI=1S/C15H11NOS/c16-9-10-5-6-12-13(17)8-11-3-1-2-4-14(11)18-15(12)7-10/h1-4,7H,5-6,8H2