2-[(3-chloranyl-4-methoxy-phenyl)methylsulfonyl-(cyanomethyl)amino]ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)methylsulfonyl-(cyanomethyl)amino]ethanamide Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)methylsulfonyl-(cyanomethyl)amino]acetamide CAS Name: 2-[(3-chloro-4-methoxyphenyl)methylsulfonyl-(cyanomethyl)amino]acetamide IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)methylsulfonyl-(cyanomethyl)amino]acetamide Traditional Name: 2-[(3-chloro-4-methoxy-benzyl)sulfonyl-(cyanomethyl)amino]acetamide Formula: C12H14ClN3O4S MolecularWeight: 331.77526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CS(=O)(=O)N(CC#N)CC(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CS(=O)(=O)N(CC#N)CC(=O)N)Cl

InChI

InChI=1S/C12H14ClN3O4S/c1-20-11-3-2-9(6-10(11)13)8-21(18,19)16(5-4-14)7-12(15)17/h2-3,6H,5,7-8H2,1H3,(H2,15,17)