methyl (2R)-2-[2-[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]oxyethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[2-[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]oxyethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[2-[(E)-3-(5-methyl-2-thienyl)prop-2-enoyl]oxyacetyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[2-[(E)-3-(5-methyl-2-thiophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]oxyacetyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[2-[(E)-3-(5-methyl-2-thienyl)acryloyl]oxyacetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)OCC(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)OCC(=O)N[C@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H21NO5S/c1-14-8-9-16(27-14)10-11-19(23)26-13-18(22)21-17(20(24)25-2)12-15-6-4-3-5-7-15/h3-11,17H,12-13H2,1-2H3,(H,21,22)/b11-10+/t17-/m1/s1