2-[(4-ethoxyphenyl)-methylsulfonyl-amino]-N-[4-(phenylsulfanylmethyl)phenyl]propanamide

Systemtic Name: 2-[(4-ethoxyphenyl)-methylsulfonyl-amino]-N-[4-(phenylsulfanylmethyl)phenyl]propanamide Openeye Name: 2-(4-ethoxy-N-methylsulfonyl-anilino)-N-[4-(phenylsulfanylmethyl)phenyl]propanamide CAS Name: 2-(4-ethoxy-N-methylsulfonylanilino)-N-[4-[(phenylthio)methyl]phenyl]propanamide IUPAC Name: 2-(4-ethoxy-N-methylsulfonylanilino)-N-[4-(phenylsulfanylmethyl)phenyl]propanamide Traditional Name: 2-(4-ethoxy-N-mesyl-anilino)-N-[4-[(phenylthio)methyl]phenyl]propionamide Formula: C25H28N2O4S2 MolecularWeight: 484.63082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H28N2O4S2/c1-4-31-23-16-14-22(15-17-23)27(33(3,29)30)19(2)25(28)26-21-12-10-20(11-13-21)18-32-24-8-6-5-7-9-24/h5-17,19H,4,18H2,1-3H3,(H,26,28)