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

Systemtic Name: 4-[[(4S)-4-ethyl-2-phenylimino-1,3-thiazolidin-3-yl]carbonyl]-2-methyl-phthalazin-1-one Openeye Name: 4-[(4S)-4-ethyl-2-phenylimino-thiazolidine-3-carbonyl]-2-methyl-phthalazin-1-one CAS Name: 4-[[(4S)-4-ethyl-2-phenylimino-3-thiazolidinyl]-oxomethyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[(4S)-4-ethyl-2-phenylimino-1,3-thiazolidine-3-carbonyl]-2-methylphthalazin-1-one Traditional Name: 4-[(4S)-4-ethyl-2-phenylimino-thiazolidine-3-carbonyl]-2-methyl-phthalazin-1-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O2S/c1-3-15-13-28-21(22-14-9-5-4-6-10-14)25(15)20(27)18-16-11-7-8-12-17(16)19(26)24(2)23-18/h4-12,15H,3,13H2,1-2H3/t15-/m0/s1