N-(1,3-benzodioxol-5-ylmethyl)-2-(thiophen-2-ylsulfonylamino)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(thiophen-2-ylsulfonylamino)-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-thienylsulfonylamino)thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(thiophen-2-ylsulfonylamino)-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(thiophen-2-ylsulfonylamino)-1,3-thiazole-4-carboxamide Traditional Name: N-piperonyl-2-(2-thienylsulfonylamino)thiazole-4-carboxamide Formula: C16H13N3O5S3 MolecularWeight: 423.48652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CSC(=N3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CSC(=N3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C16H13N3O5S3/c20-15(17-7-10-3-4-12-13(6-10)24-9-23-12)11-8-26-16(18-11)19-27(21,22)14-2-1-5-25-14/h1-6,8H,7,9H2,(H,17,20)(H,18,19)