N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[2-[2-(4-pyridyl)thiazol-4-yl]ethyl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[2-(2-pyridin-4-yl-4-thiazolyl)ethyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[2-[2-(4-pyridyl)thiazol-4-yl]ethyl]-1,3-benzodioxole-5-sulfonamide Formula: C17H15N3O4S2 MolecularWeight: 389.4487

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)NCCC3=CSC(=N3)C4=CC=NC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)NCCC3=CSC(=N3)C4=CC=NC=C4

InChI

InChI=1S/C17H15N3O4S2/c21-26(22,14-1-2-15-16(9-14)24-11-23-15)19-8-5-13-10-25-17(20-13)12-3-6-18-7-4-12/h1-4,6-7,9-10,19H,5,8,11H2