N-(2-bromophenyl)-4-(3-methyl-5-oxidanylidene-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide

Systemtic Name: N-(2-bromophenyl)-4-(3-methyl-5-oxidanylidene-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide Openeye Name: N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide CAS Name: N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenyl-4-pyrazolo[3,4-b][1,4]thiazinyl)butanamide IUPAC Name: N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenylpyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide Traditional Name: N-(2-bromophenyl)-4-(5-keto-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butyramide Formula: C22H21BrN4O2S MolecularWeight: 485.39674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N(C(=O)CS2)CCCC(=O)NC3=CC=CC=C3Br)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1N(C(=O)CS2)CCCC(=O)NC3=CC=CC=C3Br)C4=CC=CC=C4

InChI

InChI=1S/C22H21BrN4O2S/c1-15-21-22(27(25-15)16-8-3-2-4-9-16)30-14-20(29)26(21)13-7-12-19(28)24-18-11-6-5-10-17(18)23/h2-6,8-11H,7,12-14H2,1H3,(H,24,28)