ethyl 2-[2-[[2-cyano-3-(4-propoxyphenyl)prop-2-enoyl]amino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[2-cyano-3-(4-propoxyphenyl)prop-2-enoyl]amino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-cyano-3-(4-propoxyphenyl)prop-2-enoyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-cyano-1-oxo-3-(4-propoxyphenyl)prop-2-enyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-cyano-3-(4-propoxyphenyl)prop-2-enoyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-cyano-3-(4-propoxyphenyl)acryloyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)CC(=O)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)CC(=O)OCC

InChI

InChI=1S/C20H21N3O4S/c1-3-9-27-17-7-5-14(6-8-17)10-15(12-21)19(25)23-20-22-16(13-28-20)11-18(24)26-4-2/h5-8,10,13H,3-4,9,11H2,1-2H3,(H,22,23,25)