N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-piperonylamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=CC=C2S1)OC)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=CC=C2S1)OC)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25N3O4S/c1-4-24(5-2)11-12-25(21(26)15-9-10-16-18(13-15)29-14-28-16)22-23-20-17(27-3)7-6-8-19(20)30-22/h6-10,13H,4-5,11-12,14H2,1-3H3