N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(2S)-tetrahydrofuran-2-yl]methylsulfanyl]benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(2S)-2-oxolanyl]methylthio]benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(2S)-tetrahydrofuran-2-yl]methylthio]benzamide Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1C[C@H](OC1)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H23NO4S/c23-21(22-15-8-9-18-19(13-15)26-12-4-11-25-18)17-6-1-2-7-20(17)27-14-16-5-3-10-24-16/h1-2,6-9,13,16H,3-5,10-12,14H2,(H,22,23)/t16-/m0/s1