N-(1,3-benzodioxol-5-yl)-2-phenyl-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-phenyl-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-phenyl-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]-2-phenylacetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-phenyl-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-phenyl-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]acetamide Formula: C29H24N2O4S MolecularWeight: 496.57686

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O4S/c32-27(16-20-8-3-1-4-9-20)30-22-12-7-13-24(17-22)36-28(21-10-5-2-6-11-21)29(33)31-23-14-15-25-26(18-23)35-19-34-25/h1-15,17-18,28H,16,19H2,(H,30,32)(H,31,33)