N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethyl-pyrazole-4-sulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethyl-pyrazole-4-sulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethyl-pyrazole-4-sulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethyl-4-pyrazolesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethylpyrazole-4-sulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethyl-pyrazole-4-sulfonamide Formula: C16H22N4O4S MolecularWeight: 366.43528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)S(=O)(=O)NCC(C2=CC3=C(C=C2)OCO3)N(C)C

Isomeric SMILES

CCN1C=C(C=N1)S(=O)(=O)NCC(C2=CC3=C(C=C2)OCO3)N(C)C

InChI

InChI=1S/C16H22N4O4S/c1-4-20-10-13(8-17-20)25(21,22)18-9-14(19(2)3)12-5-6-15-16(7-12)24-11-23-15/h5-8,10,14,18H,4,9,11H2,1-3H3