N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(diphenylmethyl)oxyethylsulfanyl]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(diphenylmethyl)oxyethylsulfanyl]ethanamide Openeye Name: 2-(2-benzhydryloxyethylsulfanyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(diphenylmethyl)oxyethylthio]acetamide IUPAC Name: 2-(2-benzhydryloxyethylsulfanyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-(2-benzhydryloxyethylthio)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C26H27NO4S MolecularWeight: 449.56188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO4S/c28-25(27-22-12-13-23-24(18-22)30-15-7-14-29-23)19-32-17-16-31-26(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-13,18,26H,7,14-17,19H2,(H,27,28)