ethyl 2-cyano-3-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl 2-cyano-3-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]amino]prop-2-enoate Openeye Name: ethyl 2-cyano-3-[2-(3-imidazol-1-ylpropylcarbamoyl)anilino]prop-2-enoate CAS Name: 2-cyano-3-[2-[[3-(1-imidazolyl)propylamino]-oxomethyl]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[2-(3-imidazol-1-ylpropylcarbamoyl)anilino]prop-2-enoate Traditional Name: 2-cyano-3-[2-(3-imidazol-1-ylpropylcarbamoyl)anilino]acrylic acid ethyl ester Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=C1C(=O)NCCCN2C=CN=C2)C#N

Isomeric SMILES

CCOC(=O)C(=CNC1=CC=CC=C1C(=O)NCCCN2C=CN=C2)C#N

InChI

InChI=1S/C19H21N5O3/c1-2-27-19(26)15(12-20)13-23-17-7-4-3-6-16(17)18(25)22-8-5-10-24-11-9-21-14-24/h3-4,6-7,9,11,13-14,23H,2,5,8,10H2,1H3,(H,22,25)