N,N-bis(cyanomethyl)-3-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N,N-bis(cyanomethyl)-3-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N,N-bis(cyanomethyl)-3-(p-tolylsulfonylamino)propanamide CAS Name: N,N-bis(cyanomethyl)-3-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N,N-bis(cyanomethyl)-3-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N,N-bis(cyanomethyl)-3-(tosylamino)propionamide Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N(CC#N)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N(CC#N)CC#N

InChI

InChI=1S/C14H16N4O3S/c1-12-2-4-13(5-3-12)22(20,21)17-9-6-14(19)18(10-7-15)11-8-16/h2-5,17H,6,9-11H2,1H3