N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C18H20ClN3O5S2 MolecularWeight: 457.9515

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC3=C(C=C2Cl)OCCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC3=C(C=C2Cl)OCCO3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H20ClN3O5S2/c19-13-10-15-16(27-8-7-26-15)11-14(13)20-17(23)12-21-3-5-22(6-4-21)29(24,25)18-2-1-9-28-18/h1-2,9-11H,3-8,12H2,(H,20,23)