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

Systemtic Name: N-(2-dimethylaminoethyl)-4-(3-methyl-5-oxidanylidene-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide Openeye Name: N-(2-dimethylaminoethyl)-4-(3-methyl-5-oxo-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide CAS Name: N-(2-dimethylaminoethyl)-4-(3-methyl-5-oxo-1-phenyl-4-pyrazolo[3,4-b][1,4]thiazinyl)butanamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(3-methyl-5-oxo-1-phenylpyrazolo[3,4-b][1,4]thiazin-4-yl)butanamide Traditional Name: N-(2-dimethylaminoethyl)-4-(5-keto-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-4-yl)butyramide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N(C(=O)CS2)CCCC(=O)NCCN(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C2=C1N(C(=O)CS2)CCCC(=O)NCCN(C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2S/c1-15-19-20(25(22-15)16-8-5-4-6-9-16)28-14-18(27)24(19)12-7-10-17(26)21-11-13-23(2)3/h4-6,8-9H,7,10-14H2,1-3H3,(H,21,26)