ethyl (E)-3-[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[2-[(4-chlorophenyl)thio]propanoylamino]phenyl]acrylic acid ethyl ester Formula: C20H20ClNO3S MolecularWeight: 389.8957

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H20ClNO3S/c1-3-25-19(23)13-6-15-4-9-17(10-5-15)22-20(24)14(2)26-18-11-7-16(21)8-12-18/h4-14H,3H2,1-2H3,(H,22,24)/b13-6+