2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-(5-p-cumenyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H19N5O2S/c1-12(2)13-7-9-14(10-8-13)20-25-26-21(29-20)22-18(27)11-17-15-5-3-4-6-16(15)19(28)24-23-17/h3-10,12H,11H2,1-2H3,(H,24,28)(H,22,26,27)