2-[5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]thiophen-2-yl]ethanamide

Systemtic Name: 2-[5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]thiophen-2-yl]ethanamide Openeye Name: 2-[5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]-2-thienyl]acetamide CAS Name: 2-[5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]-2-thiophenyl]acetamide IUPAC Name: 2-[5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]thiophen-2-yl]acetamide Traditional Name: 2-[5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]-2-thienyl]acetamide Formula: C17H17NO4S2 MolecularWeight: 363.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)C3=CC=C(S3)CC(=O)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)C3=CC=C(S3)CC(=O)N)OC1

InChI

InChI=1S/C17H17NO4S2/c18-17(20)9-12-3-5-16(24-12)13(19)10-23-11-2-4-14-15(8-11)22-7-1-6-21-14/h2-5,8H,1,6-7,9-10H2,(H2,18,20)