ethyl (E)-2-cyano-3-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(2-methyl-5-morpholinosulfonyl-anilino)prop-2-enoate CAS Name: (E)-2-cyano-3-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(2-methyl-5-morpholin-4-ylsulfonylanilino)prop-2-enoate Traditional Name: (E)-2-cyano-3-(2-methyl-5-morpholinosulfonyl-anilino)acrylic acid ethyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)C)/C#N

InChI

InChI=1S/C17H21N3O5S/c1-3-25-17(21)14(11-18)12-19-16-10-15(5-4-13(16)2)26(22,23)20-6-8-24-9-7-20/h4-5,10,12,19H,3,6-9H2,1-2H3/b14-12+