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

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(2-diethylaminoethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-piperonylamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3S/c1-4-24(5-2)11-12-25(22-23-20-15(3)7-6-8-19(20)29-22)21(26)16-9-10-17-18(13-16)28-14-27-17/h6-10,13H,4-5,11-12,14H2,1-3H3