ethyl 2-cyano-3-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]imino-propanoate

Systemtic Name: ethyl 2-cyano-3-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]imino-propanoate Openeye Name: ethyl 2-cyano-3-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]imino-propanoate CAS Name: 2-cyano-3-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]iminopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]iminopropanoate Traditional Name: 2-cyano-3-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]imino-propionic acid ethyl ester Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)N=CC(C#N)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)N=CC(C#N)C(=O)OCC

InChI

InChI=1S/C19H20N2O2S/c1-3-14-7-9-15(10-8-14)18(17-6-5-11-24-17)21-13-16(12-20)19(22)23-4-2/h5-11,13,16,18H,3-4H2,1-2H3/t16?,18-/m1/s1