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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-piperonylamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22ClN3O3S/c1-3-24(4-2)10-11-25(21-23-19-15(22)6-5-7-18(19)29-21)20(26)14-8-9-16-17(12-14)28-13-27-16/h5-9,12H,3-4,10-11,13H2,1-2H3