2,4-dimethyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2,4-dimethyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazole-5-carboxamide Openeye Name: 2,4-dimethyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]thiazole-5-carboxamide CAS Name: 2,4-dimethyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]-5-thiazolecarboxamide IUPAC Name: 2,4-dimethyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazole-5-carboxamide Traditional Name: 2,4-dimethyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]thiazole-5-carboxamide Formula: C18H16N6OS2 MolecularWeight: 396.48924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

Isomeric SMILES

CC1=C(SC(=N1)C)C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C18H16N6OS2/c1-10-15(27-11(2)22-10)17(25)23-13-5-3-4-12(6-13)8-26-18-14-7-21-24-16(14)19-9-20-18/h3-7,9H,8H2,1-2H3,(H,23,25)(H,19,20,21,24)