5,6-dihydrobenzo[b][1]benzothiepine-4-carbonitrile

Systemtic Name: 5,6-dihydrobenzo[b][1]benzothiepine-4-carbonitrile Openeye Name: 5,6-dihydrobenzo[b][1]benzothiepine-4-carbonitrile CAS Name: 5,6-dihydrobenzo[b][1]benzothiepin-4-carbonitrile IUPAC Name: 5,6-dihydrobenzo[b][1]benzothiepine-4-carbonitrile Traditional Name: 5,6-dihydrobenzo[b][1]benzothiepin-4-carbonitrile Formula: C15H11NS MolecularWeight: 237.31954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2SC3=CC=CC=C31)C#N

Isomeric SMILES

C1CC2=C(C=CC=C2SC3=CC=CC=C31)C#N

InChI

InChI=1S/C15H11NS/c16-10-12-5-3-7-15-13(12)9-8-11-4-1-2-6-14(11)17-15/h1-7H,8-9H2