N-[3-(aminomethyl)-1-oxidanyl-3H-2,1-benzoxaborol-6-yl]-5-(1,3-oxazol-5-yl)thiophene-2-sulfonamide

Systemtic Name: N-[3-(aminomethyl)-1-oxidanyl-3H-2,1-benzoxaborol-6-yl]-5-(1,3-oxazol-5-yl)thiophene-2-sulfonamide Openeye Name: N-[3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-6-yl]-5-oxazol-5-yl-thiophene-2-sulfonamide CAS Name: N-[3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-6-yl]-5-(5-oxazolyl)-2-thiophenesulfonamide IUPAC Name: N-[3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-6-yl]-5-(1,3-oxazol-5-yl)thiophene-2-sulfonamide Traditional Name: N-[3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-6-yl]-5-oxazol-5-yl-thiophene-2-sulfonamide Formula: C15H14BN3O5S2 MolecularWeight: 391.22976

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(S3)C4=CN=CO4)C(O1)CN)O

Isomeric SMILES

B1(C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(S3)C4=CN=CO4)C(O1)CN)O

InChI

InChI=1S/C15H14BN3O5S2/c17-6-12-10-2-1-9(5-11(10)16(20)24-12)19-26(21,22)15-4-3-14(25-15)13-7-18-8-23-13/h1-5,7-8,12,19-20H,6,17H2