8-bromanyl-2-[[(3S)-3-oxidanylpyrrolidin-1-yl]methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 8-bromanyl-2-[[(3S)-3-oxidanylpyrrolidin-1-yl]methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 8-bromo-2-[[(3S)-3-hydroxypyrrolidin-1-yl]methyl]-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 8-bromo-2-[[(3S)-3-hydroxy-1-pyrrolidinyl]methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 8-bromo-2-[[(3S)-3-hydroxypyrrolidin-1-yl]methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 8-bromo-2-[[(3S)-3-hydroxypyrrolidino]methyl]-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C15H14BrN3O2S MolecularWeight: 380.25956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)CC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Br

Isomeric SMILES

C1CN(C[C@H]1O)CC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Br

InChI

InChI=1S/C15H14BrN3O2S/c16-8-1-2-11-10(5-8)13-14(22-11)15(21)18-12(17-13)7-19-4-3-9(20)6-19/h1-2,5,9,20H,3-4,6-7H2,(H,17,18,21)/t9-/m0/s1