3-cyanobutan-2-yl N-[4-[ethyl-[2-(methylsulfonylamino)ethyl]amino]-2-methyl-phenyl]carbamate

Systemtic Name: 3-cyanobutan-2-yl N-[4-[ethyl-[2-(methylsulfonylamino)ethyl]amino]-2-methyl-phenyl]carbamate Openeye Name: (2-cyano-1-methyl-propyl) N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methyl-phenyl]carbamate CAS Name: N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]carbamic acid 3-cyanobutan-2-yl ester IUPAC Name: 3-cyanobutan-2-yl N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]carbamate Traditional Name: N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methyl-phenyl]carbamic acid (2-cyano-1-methyl-propyl) ester Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)NC(=O)OC(C)C(C)C#N)C

Isomeric SMILES

CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)NC(=O)OC(C)C(C)C#N)C

InChI

InChI=1S/C18H28N4O4S/c1-6-22(10-9-20-27(5,24)25)16-7-8-17(13(2)11-16)21-18(23)26-15(4)14(3)12-19/h7-8,11,14-15,20H,6,9-10H2,1-5H3,(H,21,23)