N-(1,3-benzodioxol-5-yl)-2-[3-(phenylmethyl)quinoxalin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[3-(phenylmethyl)quinoxalin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(3-benzylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[3-(phenylmethyl)-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(3-benzylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(3-benzylquinoxalin-2-yl)thio]acetamide Formula: C24H19N3O3S MolecularWeight: 429.49096

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N=C3CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N=C3CC5=CC=CC=C5

InChI

InChI=1S/C24H19N3O3S/c28-23(25-17-10-11-21-22(13-17)30-15-29-21)14-31-24-20(12-16-6-2-1-3-7-16)26-18-8-4-5-9-19(18)27-24/h1-11,13H,12,14-15H2,(H,25,28)