N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide Openeye Name: N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]-2-(1-oxophthalazin-2-yl)acetamide CAS Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]-2-(1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-(1-oxophthalazin-2-yl)acetamide Traditional Name: N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]-2-(1-ketophthalazin-2-yl)acetamide Formula: C21H17ClN4O2S MolecularWeight: 424.90328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CN3C(=O)C4=CC=CC=C4C=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CN3C(=O)C4=CC=CC=C4C=N3)Cl

InChI

InChI=1S/C21H17ClN4O2S/c1-13-6-7-14(9-18(13)22)8-16-11-23-21(29-16)25-19(27)12-26-20(28)17-5-3-2-4-15(17)10-24-26/h2-7,9-11H,8,12H2,1H3,(H,23,25,27)