11-[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]-6H-benzo[c][1,5]benzothiazepine

Systemtic Name: 11-[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]-6H-benzo[c][1,5]benzothiazepine Openeye Name: 11-[1-[(E)-cinnamyl]-4-piperidyl]-6H-benzo[c][1,5]benzothiazepine CAS Name: 11-[1-[(E)-3-phenylprop-2-enyl]-4-piperidinyl]-6H-benzo[c][1,5]benzothiazepine IUPAC Name: 11-[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]-6H-benzo[c][1,5]benzothiazepine Traditional Name: 11-[1-[(E)-cinnamyl]-4-piperidyl]-6H-benzo[c][1,5]benzothiazepine Formula: C27H28N2S MolecularWeight: 412.58962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3CSC4=CC=CC=C42)CC=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3CSC4=CC=CC=C42)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C27H28N2S/c1-2-9-22(10-3-1)11-8-18-28-19-16-24(17-20-28)29-25-13-5-4-12-23(25)21-30-27-15-7-6-14-26(27)29/h1-15,24H,16-21H2/b11-8+