5-phenyl-1,2,4,5-tetrahydro-3-benzothiepine

Systemtic Name: 5-phenyl-1,2,4,5-tetrahydro-3-benzothiepine Openeye Name: 5-phenyl-1,2,4,5-tetrahydro-3-benzothiepine CAS Name: 5-phenyl-1,2,4,5-tetrahydro-3-benzothiepin IUPAC Name: 5-phenyl-1,2,4,5-tetrahydro-3-benzothiepine Traditional Name: 5-phenyl-1,2,4,5-tetrahydro-3-benzothiepin Formula: C16H16S MolecularWeight: 240.36324

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

C1CSCC(C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C16H16S/c1-2-6-13(7-3-1)16-12-17-11-10-14-8-4-5-9-15(14)16/h1-9,16H,10-12H2