(E)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-3-phenylsulfanyl-prop-2-enamide

Systemtic Name: (E)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-3-phenylsulfanyl-prop-2-enamide Openeye Name: (E)-N-(4-methyl-3-morpholinosulfonyl-phenyl)-3-phenylsulfanyl-prop-2-enamide CAS Name: (E)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-3-(phenylthio)-2-propenamide IUPAC Name: (E)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-phenylsulfanylprop-2-enamide Traditional Name: (E)-N-(4-methyl-3-morpholinosulfonyl-phenyl)-3-(phenylthio)acrylamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C=CSC2=CC=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C=C/SC2=CC=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H22N2O4S2/c1-16-7-8-17(15-19(16)28(24,25)22-10-12-26-13-11-22)21-20(23)9-14-27-18-5-3-2-4-6-18/h2-9,14-15H,10-13H2,1H3,(H,21,23)/b14-9+