3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(1-tert-butyl-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(1-tert-butyl-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(1-tert-butyl-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(1-tert-butyl-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C21H24N6O2S MolecularWeight: 424.51926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCN3C(=NC4=C(C3=O)C=NN4C(C)(C)C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCN3C(=NC4=C(C3=O)C=NN4C(C)(C)C)C

InChI

InChI=1S/C21H24N6O2S/c1-12-7-6-8-15-17(12)25-20(30-15)24-16(28)9-10-26-13(2)23-18-14(19(26)29)11-22-27(18)21(3,4)5/h6-8,11H,9-10H2,1-5H3,(H,24,25,28)