3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)propanamide

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)propanamide Openeye Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)propanamide CAS Name: 3-(1H-benzimidazol-2-ylthio)-N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]propanamide IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)propanamide Traditional Name: 3-(1H-benzimidazol-2-ylthio)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)propionamide Formula: C19H18N4O4S MolecularWeight: 398.43562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H18N4O4S/c24-17(7-10-28-19-21-13-3-1-2-4-14(13)22-19)23-18(25)20-12-5-6-15-16(11-12)27-9-8-26-15/h1-6,11H,7-10H2,(H,21,22)(H2,20,23,24,25)