5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carbonitrile

Systemtic Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carbonitrile Openeye Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carbonitrile CAS Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carbonitrile IUPAC Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carbonitrile Traditional Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carbonitrile Formula: C14H10N2S MolecularWeight: 238.3076

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2SC3=C(N1)C=CC(=C3)C#N

Isomeric SMILES

C1C2=CC=CC=C2SC3=C(N1)C=CC(=C3)C#N

InChI

InChI=1S/C14H10N2S/c15-8-10-5-6-12-14(7-10)17-13-4-2-1-3-11(13)9-16-12/h1-7,16H,9H2