N-[2-(pyrimidin-2-ylamino)ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-(pyrimidin-2-ylamino)ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-(pyrimidin-2-ylamino)ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-(2-pyrimidinylamino)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-(pyrimidin-2-ylamino)ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-(2-pyrimidylamino)ethyl]isoquinoline-5-sulfonamide Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCCNC3=NC=CC=N3

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCCNC3=NC=CC=N3

InChI

InChI=1S/C15H15N5O2S/c21-23(22,20-10-9-19-15-17-6-2-7-18-15)14-4-1-3-12-11-16-8-5-13(12)14/h1-8,11,20H,9-10H2,(H,17,18,19)