3-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazinane-4-carboxamide

Systemtic Name: 3-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazinane-4-carboxamide Openeye Name: 3-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazinane-4-carboxamide CAS Name: 3-methyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]-1,3-thiazinane-4-carboxamide IUPAC Name: 3-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]-1,3-thiazinane-4-carboxamide Traditional Name: 3-methyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]-1,3-thiazinane-4-carboxamide Formula: C18H20N6OS2 MolecularWeight: 400.521

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Descriptors Computed from Structure

Canonical SMILES:

CN1CSCCC1C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

Isomeric SMILES

CN1CSCCC1C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C18H20N6OS2/c1-24-11-26-6-5-15(24)17(25)22-13-4-2-3-12(7-13)9-27-18-14-8-21-23-16(14)19-10-20-18/h2-4,7-8,10,15H,5-6,9,11H2,1H3,(H,22,25)(H,19,20,21,23)