3-methyl-5,6-dihydro-1H-pyrimido[4,5-b][1,5]benzothiazepine-2,4-dione

Systemtic Name: 3-methyl-5,6-dihydro-1H-pyrimido[4,5-b][1,5]benzothiazepine-2,4-dione Openeye Name: 3-methyl-5,6-dihydro-1H-pyrimido[4,5-b][1,5]benzothiazepine-2,4-dione CAS Name: 3-methyl-5,6-dihydro-1H-pyrimido[4,5-b][1,5]benzothiazepine-2,4-dione IUPAC Name: 3-methyl-5,6-dihydro-1H-pyrimido[4,5-b][1,5]benzothiazepine-2,4-dione Traditional Name: 3-methyl-5,6-dihydro-1H-pyrimido[4,5-b][1,5]benzothiazepine-2,4-quinone Formula: C12H11N3O2S MolecularWeight: 261.29964

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(NC1=O)SC3=CC=CC=C3NC2

Isomeric SMILES

CN1C(=O)C2=C(NC1=O)SC3=CC=CC=C3NC2

InChI

InChI=1S/C12H11N3O2S/c1-15-11(16)7-6-13-8-4-2-3-5-9(8)18-10(7)14-12(15)17/h2-5,13H,6H2,1H3,(H,14,17)