N-[3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]butane-1-sulfonamide

Systemtic Name: N-[3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]butane-1-sulfonamide Openeye Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]butane-1-sulfonamide CAS Name: N-[3-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)phenyl]-1-butanesulfonamide IUPAC Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]butane-1-sulfonamide Traditional Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]butane-1-sulfonamide Formula: C15H18N6O2S MolecularWeight: 346.40742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC=CC(=C1)N2C3=C(C=N2)C(=NC=N3)N

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC=CC(=C1)N2C3=C(C=N2)C(=NC=N3)N

InChI

InChI=1S/C15H18N6O2S/c1-2-3-7-24(22,23)20-11-5-4-6-12(8-11)21-15-13(9-19-21)14(16)17-10-18-15/h4-6,8-10,20H,2-3,7H2,1H3,(H2,16,17,18)