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

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetamide Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)NC3=C(N=CC=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)NC3=C(N=CC=C3)Cl)OC1

InChI

InChI=1S/C16H15ClN2O3S/c17-16-12(3-1-6-18-16)19-15(20)10-23-11-4-5-13-14(9-11)22-8-2-7-21-13/h1,3-6,9H,2,7-8,10H2,(H,19,20)