5-oxidanylidene-3,4-dihydro-2H-1-benzothiepine-4-carbonitrile

Systemtic Name: 5-oxidanylidene-3,4-dihydro-2H-1-benzothiepine-4-carbonitrile Openeye Name: 5-oxo-3,4-dihydro-2H-1-benzothiepine-4-carbonitrile CAS Name: 5-oxo-3,4-dihydro-2H-1-benzothiepin-4-carbonitrile IUPAC Name: 5-oxo-3,4-dihydro-2H-1-benzothiepine-4-carbonitrile Traditional Name: 5-keto-3,4-dihydro-2H-1-benzothiepin-4-carbonitrile Formula: C11H9NOS MolecularWeight: 203.26026

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C(=O)C1C#N

Isomeric SMILES

C1CSC2=CC=CC=C2C(=O)C1C#N

InChI

InChI=1S/C11H9NOS/c12-7-8-5-6-14-10-4-2-1-3-9(10)11(8)13/h1-4,8H,5-6H2