(E)-N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-3-(p-tolyl)acrylamide Formula: C22H20ClNO3S2 MolecularWeight: 445.9821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NCC(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NCC(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H20ClNO3S2/c1-16-4-6-17(7-5-16)8-13-21(25)24-15-20(18-9-11-19(23)12-10-18)29(26,27)22-3-2-14-28-22/h2-14,20H,15H2,1H3,(H,24,25)/b13-8+