(4E)-4-(piperidin-1-ylmethylidene)-2,3-dihydro-1-benzothiepin-5-one

Systemtic Name: (4E)-4-(piperidin-1-ylmethylidene)-2,3-dihydro-1-benzothiepin-5-one Openeye Name: (4E)-4-(1-piperidylmethylene)-2,3-dihydro-1-benzothiepin-5-one CAS Name: (4E)-4-(1-piperidinylmethylidene)-2,3-dihydro-1-benzothiepin-5-one IUPAC Name: (4E)-4-(piperidin-1-ylmethylidene)-2,3-dihydro-1-benzothiepin-5-one Traditional Name: (4E)-4-(piperidinomethylene)-2,3-dihydro-1-benzothiepin-5-one Formula: C16H19NOS MolecularWeight: 273.39316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C=C2CCSC3=CC=CC=C3C2=O

Isomeric SMILES

C1CCN(CC1)/C=C/2\CCSC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H19NOS/c18-16-13(12-17-9-4-1-5-10-17)8-11-19-15-7-3-2-6-14(15)16/h2-3,6-7,12H,1,4-5,8-11H2/b13-12+