N-benzo[e][1,3]benzothiazol-2-yl-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-2-(4-methyl-1-oxo-phthalazin-2-yl)acetamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-2-(4-methyl-1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-2-(4-methyl-1-oxophthalazin-2-yl)acetamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-2-(1-keto-4-methyl-phthalazin-2-yl)acetamide Formula: C22H16N4O2S MolecularWeight: 400.45304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C22H16N4O2S/c1-13-15-7-4-5-9-17(15)21(28)26(25-13)12-19(27)23-22-24-20-16-8-3-2-6-14(16)10-11-18(20)29-22/h2-11H,12H2,1H3,(H,23,24,27)