N-(2-methyl-1,3-benzothiazol-5-yl)isoquinoline-5-sulfonamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-5-yl)isoquinoline-5-sulfonamide Openeye Name: N-(2-methyl-1,3-benzothiazol-5-yl)isoquinoline-5-sulfonamide CAS Name: N-(2-methyl-1,3-benzothiazol-5-yl)-5-isoquinolinesulfonamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-5-yl)isoquinoline-5-sulfonamide Traditional Name: N-(2-methyl-1,3-benzothiazol-5-yl)isoquinoline-5-sulfonamide Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C17H13N3O2S2/c1-11-19-15-9-13(5-6-16(15)23-11)20-24(21,22)17-4-2-3-12-10-18-8-7-14(12)17/h2-10,20H,1H3