4-[2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]propanoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-1-oxopropyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C21H25N5O4S2 MolecularWeight: 475.5843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)SC3=NC=C(C=C3)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)SC3=NC=C(C=C3)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H25N5O4S2/c1-15(21(28)26-14-19(27)23-17-5-3-4-6-18(17)26)31-20-8-7-16(13-22-20)32(29,30)25-11-9-24(2)10-12-25/h3-8,13,15H,9-12,14H2,1-2H3,(H,23,27)