1,3,3a,4,5,9b-hexahydrobenzo[e]isoindol-2-yl-(1-phenylsulfanylcyclopropyl)methanone

Systemtic Name: 1,3,3a,4,5,9b-hexahydrobenzo[e]isoindol-2-yl-(1-phenylsulfanylcyclopropyl)methanone Openeye Name: 1,3,3a,4,5,9b-hexahydrobenzo[e]isoindol-2-yl-(1-phenylsulfanylcyclopropyl)methanone CAS Name: 1,3,3a,4,5,9b-hexahydrobenzo[e]isoindol-2-yl-[1-(phenylthio)cyclopropyl]methanone IUPAC Name: 1,3,3a,4,5,9b-hexahydrobenzo[e]isoindol-2-yl-(1-phenylsulfanylcyclopropyl)methanone Traditional Name: 1,3,3a,4,5,9b-hexahydrobenz[e]isoindol-2-yl-[1-(phenylthio)cyclopropyl]methanone Formula: C22H23NOS MolecularWeight: 349.48912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C3C1CN(C3)C(=O)C4(CC4)SC5=CC=CC=C5

Isomeric SMILES

C1CC2=CC=CC=C2C3C1CN(C3)C(=O)C4(CC4)SC5=CC=CC=C5

InChI

InChI=1S/C22H23NOS/c24-21(22(12-13-22)25-18-7-2-1-3-8-18)23-14-17-11-10-16-6-4-5-9-19(16)20(17)15-23/h1-9,17,20H,10-15H2