7-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]-1,3-dimethyl-xanthine Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2SC(=N1)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2SC(=N1)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)C

InChI

InChI=1S/C18H19N5O2S/c1-18(2)11-7-5-6-8-12(11)26-13(20-18)9-23-10-19-15-14(23)16(24)22(4)17(25)21(15)3/h5-8,10H,9H2,1-4H3