N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]propanamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[(5-phenyl-1H-imidazol-2-yl)thio]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(5-phenyl-1H-imidazol-2-yl)thio]propionamide Formula: C21H20N4O4S MolecularWeight: 424.4729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC2=C(C=C1)OCCO2)SC3=NC=C(N3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC2=C(C=C1)OCCO2)SC3=NC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O4S/c1-13(30-21-22-12-16(24-21)14-5-3-2-4-6-14)19(26)25-20(27)23-15-7-8-17-18(11-15)29-10-9-28-17/h2-8,11-13H,9-10H2,1H3,(H,22,24)(H2,23,25,26,27)