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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-piperonylamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-3-23(4-2)11-12-24(21-22-16-7-5-6-8-19(16)28-21)20(25)15-9-10-17-18(13-15)27-14-26-17/h5-10,13H,3-4,11-12,14H2,1-2H3