3-[2-oxidanylidene-2-[2-(phenylmethyl)imino-1,3-thiazolidin-3-yl]ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-oxidanylidene-2-[2-(phenylmethyl)imino-1,3-thiazolidin-3-yl]ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-(2-benzyliminothiazolidin-3-yl)-2-oxo-ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-oxo-2-[2-(phenylmethyl)imino-3-thiazolidinyl]ethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-(2-benzylimino-1,3-thiazolidin-3-yl)-2-oxoethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-(2-benzyliminothiazolidin-3-yl)-2-keto-ethyl]-2H-phthalazine-1,4-quinone Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=NCC2=CC=CC=C2)N1C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CSC(=NCC2=CC=CC=C2)N1C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C20H18N4O3S/c25-17(13-24-19(27)16-9-5-4-8-15(16)18(26)22-24)23-10-11-28-20(23)21-12-14-6-2-1-3-7-14/h1-9H,10-13H2,(H,22,26)