6-ethyl-9-methyl-3-propyl-5,6-dihydrobenzo[b][1]benzothiepine

Systemtic Name: 6-ethyl-9-methyl-3-propyl-5,6-dihydrobenzo[b][1]benzothiepine Openeye Name: 6-ethyl-9-methyl-3-propyl-5,6-dihydrobenzo[b][1]benzothiepine CAS Name: 6-ethyl-9-methyl-3-propyl-5,6-dihydrobenzo[b][1]benzothiepin IUPAC Name: 6-ethyl-9-methyl-3-propyl-5,6-dihydrobenzo[b][1]benzothiepine Traditional Name: 6-ethyl-9-methyl-3-propyl-5,6-dihydrobenzo[b][1]benzothiepin Formula: C20H24S MolecularWeight: 296.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)SC3=C(C=CC(=C3)C)C(C2)CC

Isomeric SMILES

CCCC1=CC2=C(C=C1)SC3=C(C=CC(=C3)C)C(C2)CC

InChI

InChI=1S/C20H24S/c1-4-6-15-8-10-19-17(12-15)13-16(5-2)18-9-7-14(3)11-20(18)21-19/h7-12,16H,4-6,13H2,1-3H3