2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-1-(4-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Openeye Name: 2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]-1-(4-methyl-1-piperidyl)ethanone CAS Name: 2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-1-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Traditional Name: 2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]-1-(4-methylpiperidino)ethanone Formula: C18H28N4O3S2 MolecularWeight: 412.56992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C18H28N4O3S2/c1-15-5-7-21(8-6-15)18(23)14-26-17-4-3-16(13-19-17)27(24,25)22-11-9-20(2)10-12-22/h3-4,13,15H,5-12,14H2,1-2H3