2,4-dimethyl-3-[6-(4-methylpiperazin-1-yl)hexoxy]-2H-thiophen-5-one

Systemtic Name: 2,4-dimethyl-3-[6-(4-methylpiperazin-1-yl)hexoxy]-2H-thiophen-5-one Openeye Name: 2,4-dimethyl-3-[6-(4-methylpiperazin-1-yl)hexoxy]-2H-thiophen-5-one CAS Name: 2,4-dimethyl-3-[6-(4-methyl-1-piperazinyl)hexoxy]-2H-thiophen-5-one IUPAC Name: 2,4-dimethyl-3-[6-(4-methylpiperazin-1-yl)hexoxy]-2H-thiophen-5-one Traditional Name: 2,4-dimethyl-3-[6-(4-methylpiperazino)hexoxy]-2H-thiophen-5-one Formula: C17H30N2O2S MolecularWeight: 326.4973

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(C(=O)S1)C)OCCCCCCN2CCN(CC2)C

Isomeric SMILES

CC1C(=C(C(=O)S1)C)OCCCCCCN2CCN(CC2)C

InChI

InChI=1S/C17H30N2O2S/c1-14-16(15(2)22-17(14)20)21-13-7-5-4-6-8-19-11-9-18(3)10-12-19/h15H,4-13H2,1-3H3