2-(4-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-ethanamide

Systemtic Name: 2-(4-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-ethanamide Openeye Name: 2-(4-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-acetamide CAS Name: 2-[(4-aminophenyl)thio]-N-(1,3-benzodioxol-5-ylmethyl)-2-phenylacetamide IUPAC Name: 2-(4-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-2-phenylacetamide Traditional Name: 2-[(4-aminophenyl)thio]-2-phenyl-N-piperonyl-acetamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)N

InChI

InChI=1S/C22H20N2O3S/c23-17-7-9-18(10-8-17)28-21(16-4-2-1-3-5-16)22(25)24-13-15-6-11-19-20(12-15)27-14-26-19/h1-12,21H,13-14,23H2,(H,24,25)