4-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-[(2-methylthiazol-4-yl)methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-[(2-methylthiazol-4-yl)methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=NC(=CS1)CN2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H19N5O2S/c1-12-19-13(11-26-12)10-22-6-8-23(9-7-22)18(25)16-14-4-2-3-5-15(14)17(24)21-20-16/h2-5,11H,6-10H2,1H3,(H,21,24)