3-[2-[4-[(4-methyl-2-oxidanylidene-3H-1,3-thiazol-5-yl)sulfonyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-[4-[(4-methyl-2-oxidanylidene-3H-1,3-thiazol-5-yl)sulfonyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-[4-[(4-methyl-2-oxo-3H-thiazol-5-yl)sulfonyl]piperazin-1-yl]-2-oxo-ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-[4-[(4-methyl-2-oxo-3H-thiazol-5-yl)sulfonyl]-1-piperazinyl]-2-oxoethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-[4-[(4-methyl-2-oxo-3H-1,3-thiazol-5-yl)sulfonyl]piperazin-1-yl]-2-oxoethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-keto-2-[4-[(2-keto-4-methyl-4-thiazolin-5-yl)sulfonyl]piperazino]ethyl]-2H-phthalazine-1,4-quinone Formula: C18H19N5O6S2 MolecularWeight: 465.50336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C18H19N5O6S2/c1-11-17(30-18(27)19-11)31(28,29)22-8-6-21(7-9-22)14(24)10-23-16(26)13-5-3-2-4-12(13)15(25)20-23/h2-5H,6-10H2,1H3,(H,19,27)(H,20,25)