5-[[5-bromanyl-4-(cyclobutylamino)pyrimidin-2-yl]amino]-1,3-benzoxathiol-2-one

Systemtic Name: 5-[[5-bromanyl-4-(cyclobutylamino)pyrimidin-2-yl]amino]-1,3-benzoxathiol-2-one Openeye Name: 5-[[5-bromo-4-(cyclobutylamino)pyrimidin-2-yl]amino]-1,3-benzoxathiol-2-one CAS Name: 5-[[5-bromo-4-(cyclobutylamino)-2-pyrimidinyl]amino]-1,3-benzoxathiol-2-one IUPAC Name: 5-[[5-bromo-4-(cyclobutylamino)pyrimidin-2-yl]amino]-1,3-benzoxathiol-2-one Traditional Name: 5-[[5-bromo-4-(cyclobutylamino)pyrimidin-2-yl]amino]-1,3-benzoxathiol-2-one Formula: C15H13BrN4O2S MolecularWeight: 393.25832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)OC(=O)S4

Isomeric SMILES

C1CC(C1)NC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)OC(=O)S4

InChI

InChI=1S/C15H13BrN4O2S/c16-10-7-17-14(20-13(10)18-8-2-1-3-8)19-9-4-5-11-12(6-9)23-15(21)22-11/h4-8H,1-3H2,(H2,17,18,19,20)