2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(diphenylmethyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(diphenylmethyl)ethanamide Openeye Name: N-benzhydryl-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(diphenylmethyl)acetamide IUPAC Name: N-benzhydryl-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetamide Traditional Name: N-benzhydryl-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetamide Formula: C24H23NO3S MolecularWeight: 405.50932

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)OC1

InChI

InChI=1S/C24H23NO3S/c26-23(17-29-20-12-13-21-22(16-20)28-15-7-14-27-21)25-24(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-13,16,24H,7,14-15,17H2,(H,25,26)