2-[(3-butylphenyl)methylsulfonyl-(cyanomethyl)amino]ethanamide

Systemtic Name: 2-[(3-butylphenyl)methylsulfonyl-(cyanomethyl)amino]ethanamide Openeye Name: 2-[(3-butylphenyl)methylsulfonyl-(cyanomethyl)amino]acetamide CAS Name: 2-[(3-butylphenyl)methylsulfonyl-(cyanomethyl)amino]acetamide IUPAC Name: 2-[(3-butylphenyl)methylsulfonyl-(cyanomethyl)amino]acetamide Traditional Name: 2-[(3-butylbenzyl)sulfonyl-(cyanomethyl)amino]acetamide Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)CS(=O)(=O)N(CC#N)CC(=O)N

Isomeric SMILES

CCCCC1=CC(=CC=C1)CS(=O)(=O)N(CC#N)CC(=O)N

InChI

InChI=1S/C15H21N3O3S/c1-2-3-5-13-6-4-7-14(10-13)12-22(20,21)18(9-8-16)11-15(17)19/h4,6-7,10H,2-3,5,9,11-12H2,1H3,(H2,17,19)