N-(3-fluoranyl-4-methoxy-phenyl)-N-propylsulfonyl-3-(thiophen-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(3-fluoranyl-4-methoxy-phenyl)-N-propylsulfonyl-3-(thiophen-2-ylsulfanylmethyl)benzamide Openeye Name: N-(3-fluoro-4-methoxy-phenyl)-N-propylsulfonyl-3-(2-thienylsulfanylmethyl)benzamide CAS Name: N-(3-fluoro-4-methoxyphenyl)-N-propylsulfonyl-3-[(thiophen-2-ylthio)methyl]benzamide IUPAC Name: N-(3-fluoro-4-methoxyphenyl)-N-propylsulfonyl-3-(thiophen-2-ylsulfanylmethyl)benzamide Traditional Name: N-(3-fluoro-4-methoxy-phenyl)-N-propylsulfonyl-3-[(2-thienylthio)methyl]benzamide Formula: C22H22FNO4S3 MolecularWeight: 479.607783

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=CC=C2)CSC3=CC=CS3

Isomeric SMILES

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=CC=C2)CSC3=CC=CS3

InChI

InChI=1S/C22H22FNO4S3/c1-3-12-31(26,27)24(18-9-10-20(28-2)19(23)14-18)22(25)17-7-4-6-16(13-17)15-30-21-8-5-11-29-21/h4-11,13-14H,3,12,15H2,1-2H3