3-tert-butyl-1-cyclopentyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-1-cyclopentyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-1-cyclopentyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-1-cyclopentyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-1-cyclopentyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-1-cyclopentyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide Formula: C21H28N4O3S2 MolecularWeight: 448.60202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CN(N=C3C(C)(C)C)C4CCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CN(N=C3C(C)(C)C)C4CCCC4

InChI

InChI=1S/C21H28N4O3S2/c1-5-28-15-10-11-16-17(12-15)29-20(22-16)24-30(26,27)18-13-25(14-8-6-7-9-14)23-19(18)21(2,3)4/h10-14H,5-9H2,1-4H3,(H,22,24)