3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1-methyl-2-imidazolyl)-phenylmethyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propionamide Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H23N3O5S/c1-25-11-10-23-22(25)21(16-5-3-2-4-6-16)24-20(26)9-14-31(27,28)17-7-8-18-19(15-17)30-13-12-29-18/h2-8,10-11,15,21H,9,12-14H2,1H3,(H,24,26)