N-(2,2-dimethyl-1,3-benzodioxol-5-yl)-2-(phenylmethylsulfanyl)benzamide

Systemtic Name: N-(2,2-dimethyl-1,3-benzodioxol-5-yl)-2-(phenylmethylsulfanyl)benzamide Openeye Name: 2-benzylsulfanyl-N-(2,2-dimethyl-1,3-benzodioxol-5-yl)benzamide CAS Name: N-(2,2-dimethyl-1,3-benzodioxol-5-yl)-2-(phenylmethylthio)benzamide IUPAC Name: 2-benzylsulfanyl-N-(2,2-dimethyl-1,3-benzodioxol-5-yl)benzamide Traditional Name: 2-(benzylthio)-N-(2,2-dimethyl-1,3-benzodioxol-5-yl)benzamide Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4)C

Isomeric SMILES

CC1(OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4)C

InChI

InChI=1S/C23H21NO3S/c1-23(2)26-19-13-12-17(14-20(19)27-23)24-22(25)18-10-6-7-11-21(18)28-15-16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,24,25)