2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(esyl)amino]-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC(=O)NC1=C(C=C(C=C1)CSC2=CC=CC=C2)C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCS(=O)(=O)N(CC(=O)NC1=C(C=C(C=C1)CSC2=CC=CC=C2)C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H26N2O5S2/c1-3-34(29,30)27(20-10-12-23-24(14-20)32-17-31-23)15-25(28)26-22-11-9-19(13-18(22)2)16-33-21-7-5-4-6-8-21/h4-14H,3,15-17H2,1-2H3,(H,26,28)