ethyl 4-[[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]amino]-4-oxo-butanoate CAS Name: 4-[[4-[3-(cyanomethyl)-4-methoxyphenyl]-2-thiazolyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[3-(cyanomethyl)-4-methoxyphenyl]-1,3-thiazol-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]amino]-4-keto-butyric acid ethyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)CC#N

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)CC#N

InChI

InChI=1S/C18H19N3O4S/c1-3-25-17(23)7-6-16(22)21-18-20-14(11-26-18)12-4-5-15(24-2)13(10-12)8-9-19/h4-5,10-11H,3,6-8H2,1-2H3,(H,20,21,22)