4-[[(4S)-4-ethyl-2-(4-methylphenyl)imino-1,3-thiazolidin-3-yl]carbonyl]-2-methyl-phthalazin-1-one

Systemtic Name: 4-[[(4S)-4-ethyl-2-(4-methylphenyl)imino-1,3-thiazolidin-3-yl]carbonyl]-2-methyl-phthalazin-1-one Openeye Name: 4-[(4S)-4-ethyl-2-(p-tolylimino)thiazolidine-3-carbonyl]-2-methyl-phthalazin-1-one CAS Name: 4-[[(4S)-4-ethyl-2-(4-methylphenyl)imino-3-thiazolidinyl]-oxomethyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[(4S)-4-ethyl-2-(4-methylphenyl)imino-1,3-thiazolidine-3-carbonyl]-2-methylphthalazin-1-one Traditional Name: 4-[(4S)-4-ethyl-2-(p-tolylimino)thiazolidine-3-carbonyl]-2-methyl-phthalazin-1-one Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CSC(=NC2=CC=C(C=C2)C)N1C(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC[C@H]1CSC(=NC2=CC=C(C=C2)C)N1C(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C22H22N4O2S/c1-4-16-13-29-22(23-15-11-9-14(2)10-12-15)26(16)21(28)19-17-7-5-6-8-18(17)20(27)25(3)24-19/h5-12,16H,4,13H2,1-3H3/t16-/m0/s1