N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(phenylthio)propanamide IUPAC Name: N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-phenylsulfanylpropanamide Traditional Name: N-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]-3-(phenylthio)propionamide Formula: C22H23NO4S3 MolecularWeight: 461.61732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)CCSC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)CCSC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C22H23NO4S3/c1-27-17-9-11-19(12-10-17)30(25,26)21(20-8-5-14-29-20)16-23-22(24)13-15-28-18-6-3-2-4-7-18/h2-12,14,21H,13,15-16H2,1H3,(H,23,24)