N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenylsulfanyl-propanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenylsulfanyl-propanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenylsulfanyl-propanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(phenylthio)propanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenylsulfanylpropanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(phenylthio)propionamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCCO2)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCCCO2)SC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3S/c1-13(23-15-6-3-2-4-7-15)18(20)19-14-8-9-16-17(12-14)22-11-5-10-21-16/h2-4,6-9,12-13H,5,10-11H2,1H3,(H,19,20)