(E)-N-[2-(4-methylphenyl)sulfanylethyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-methylphenyl)sulfanylethyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(4-morpholinosulfonylphenyl)-N-[2-(p-tolylsulfanyl)ethyl]prop-2-enamide CAS Name: (E)-N-[2-[(4-methylphenyl)thio]ethyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[2-(4-methylphenyl)sulfanylethyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-morpholinosulfonylphenyl)-N-[2-(p-tolylthio)ethyl]acrylamide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H26N2O4S2/c1-18-2-7-20(8-3-18)29-17-12-23-22(25)11-6-19-4-9-21(10-5-19)30(26,27)24-13-15-28-16-14-24/h2-11H,12-17H2,1H3,(H,23,25)/b11-6+