4-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)imino-1,3-thiazol-4-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)imino-1,3-thiazol-4-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)imino-thiazol-4-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)imino-4-thiazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxyphenyl)imino-1,3-thiazol-4-yl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-4-(3-piperonyl-2-p-phenetylimino-4-thiazolin-4-yl)benzenesulfonamide Formula: C29H31N3O5S2 MolecularWeight: 565.70354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=NC3=CC=C(C=C3)OCC)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=NC3=CC=C(C=C3)OCC)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H31N3O5S2/c1-4-31(5-2)39(33,34)25-14-8-22(9-15-25)26-19-38-29(30-23-10-12-24(13-11-23)35-6-3)32(26)18-21-7-16-27-28(17-21)37-20-36-27/h7-17,19H,4-6,18,20H2,1-3H3