3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]propanamide

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]propanamide Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]propanamide CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]propanamide IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]propanamide Traditional Name: N-(4-ethoxybenzyl)-3-piazthiol-4-ylsulfonyl-propionamide Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)CCS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)CCS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H19N3O4S2/c1-2-25-14-8-6-13(7-9-14)12-19-17(22)10-11-27(23,24)16-5-3-4-15-18(16)21-26-20-15/h3-9H,2,10-12H2,1H3,(H,19,22)