N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(4-methyl-1-oxo-phthalazin-2-yl)acetamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(4-methyl-1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(4-methyl-1-oxophthalazin-2-yl)acetamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(1-keto-4-methyl-phthalazin-2-yl)acetamide Formula: C18H13BrN4O2S MolecularWeight: 429.29042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C18H13BrN4O2S/c1-10-12-4-2-3-5-13(12)17(25)23(22-10)9-16(24)21-18-20-14-7-6-11(19)8-15(14)26-18/h2-8H,9H2,1H3,(H,20,21,24)