S-methyl (E)-2-cyano-3-[1-(3,4-dichlorophenyl)ethylamino]but-2-enethioate

Systemtic Name: S-methyl (E)-2-cyano-3-[1-(3,4-dichlorophenyl)ethylamino]but-2-enethioate Openeye Name: S-methyl (E)-2-cyano-3-[1-(3,4-dichlorophenyl)ethylamino]but-2-enethioate CAS Name: (E)-2-cyano-3-[1-(3,4-dichlorophenyl)ethylamino]-2-butenethioic acid S-methyl ester IUPAC Name: S-methyl (E)-2-cyano-3-[1-(3,4-dichlorophenyl)ethylamino]but-2-enethioate Traditional Name: (E)-2-cyano-3-[1-(3,4-dichlorophenyl)ethylamino]but-2-enethioic acid S-methyl ester Formula: C14H14Cl2N2OS MolecularWeight: 329.24476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Cl)NC(=C(C#N)C(=O)SC)C

Isomeric SMILES

CC(C1=CC(=C(C=C1)Cl)Cl)N/C(=C(\C#N)/C(=O)SC)/C

InChI

InChI=1S/C14H14Cl2N2OS/c1-8(10-4-5-12(15)13(16)6-10)18-9(2)11(7-17)14(19)20-3/h4-6,8,18H,1-3H3/b11-9+