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

Systemtic Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-phenylimino-1,3-thiazol-4-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-phenylimino-thiazol-4-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-phenylimino-4-thiazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[3-(1,3-benzodioxol-5-ylmethyl)-2-phenylimino-1,3-thiazol-4-yl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-4-(2-phenylimino-3-piperonyl-4-thiazolin-4-yl)benzenesulfonamide Formula: C27H27N3O4S2 MolecularWeight: 521.65098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O4S2/c1-3-29(4-2)36(31,32)23-13-11-21(12-14-23)24-18-35-27(28-22-8-6-5-7-9-22)30(24)17-20-10-15-25-26(16-20)34-19-33-25/h5-16,18H,3-4,17,19H2,1-2H3