ethyl 2-cyano-3-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]imino-propanoate

Systemtic Name: ethyl 2-cyano-3-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]imino-propanoate Openeye Name: ethyl 2-cyano-3-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]imino-propanoate CAS Name: 2-cyano-3-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]iminopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]iminopropanoate Traditional Name: 2-cyano-3-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]imino-propionic acid ethyl ester Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(C)N=CC(C#N)C(=O)OCC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)[C@H](C)N=CC(C#N)C(=O)OCC

InChI

InChI=1S/C18H25N3O4S/c1-5-21(6-2)26(23,24)17-10-8-15(9-11-17)14(4)20-13-16(12-19)18(22)25-7-3/h8-11,13-14,16H,5-7H2,1-4H3/t14-,16?/m0/s1