N-[2-[4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]butane-1-sulfonamide

Systemtic Name: N-[2-[4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]butane-1-sulfonamide Openeye Name: N-[2-[4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]butane-1-sulfonamide CAS Name: N-[2-[4-(1-azepanyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-1-butanesulfonamide IUPAC Name: N-[2-[4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]butane-1-sulfonamide Traditional Name: N-[2-[4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]butane-1-sulfonamide Formula: C17H28N6O2S MolecularWeight: 380.50822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NCCN1C2=C(C=N1)C(=NC=N2)N3CCCCCC3

Isomeric SMILES

CCCCS(=O)(=O)NCCN1C2=C(C=N1)C(=NC=N2)N3CCCCCC3

InChI

InChI=1S/C17H28N6O2S/c1-2-3-12-26(24,25)21-8-11-23-17-15(13-20-23)16(18-14-19-17)22-9-6-4-5-7-10-22/h13-14,21H,2-12H2,1H3