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

Systemtic Name: 3-[2-[4,4-dimethyl-2-(phenylmethyl)imino-1,3-thiazolidin-3-yl]-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-(2-benzylimino-4,4-dimethyl-thiazolidin-3-yl)-2-oxo-ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-[4,4-dimethyl-2-(phenylmethyl)imino-3-thiazolidinyl]-2-oxoethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-(2-benzylimino-4,4-dimethyl-1,3-thiazolidin-3-yl)-2-oxoethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-(2-benzylimino-4,4-dimethyl-thiazolidin-3-yl)-2-keto-ethyl]-2H-phthalazine-1,4-quinone Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC(=NCC2=CC=CC=C2)N1C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3)C

Isomeric SMILES

CC1(CSC(=NCC2=CC=CC=C2)N1C(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3)C

InChI

InChI=1S/C22H22N4O3S/c1-22(2)14-30-21(23-12-15-8-4-3-5-9-15)26(22)18(27)13-25-20(29)17-11-7-6-10-16(17)19(28)24-25/h3-11H,12-14H2,1-2H3,(H,24,28)