N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H24ClN3O3S/c1-24-6-8-25(9-7-24)18-4-2-15(22)12-17(18)23-21(26)14-29-16-3-5-19-20(13-16)28-11-10-27-19/h2-5,12-13H,6-11,14H2,1H3,(H,23,26)