2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]acetamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CSC3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CSC3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C23H29N3O3S/c1-3-25-8-10-26(11-9-25)18-4-6-20(17(2)14-18)24-23(27)16-30-19-5-7-21-22(15-19)29-13-12-28-21/h4-7,14-15H,3,8-13,16H2,1-2H3,(H,24,27)