1-cyanopropan-2-yl N-[4-(diethylamino)-2-(2-methylsulfonylethyl)phenyl]carbamate

Systemtic Name: 1-cyanopropan-2-yl N-[4-(diethylamino)-2-(2-methylsulfonylethyl)phenyl]carbamate Openeye Name: (2-cyano-1-methyl-ethyl) N-[4-(diethylamino)-2-(2-methylsulfonylethyl)phenyl]carbamate CAS Name: N-[4-(diethylamino)-2-(2-methylsulfonylethyl)phenyl]carbamic acid 1-cyanopropan-2-yl ester IUPAC Name: 1-cyanopropan-2-yl N-[4-(diethylamino)-2-(2-methylsulfonylethyl)phenyl]carbamate Traditional Name: N-[4-(diethylamino)-2-(2-mesylethyl)phenyl]carbamic acid (2-cyano-1-methyl-ethyl) ester Formula: C18H27N3O4S MolecularWeight: 381.48968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O4S/c1-5-21(6-2)16-7-8-17(15(13-16)10-12-26(4,23)24)20-18(22)25-14(3)9-11-19/h7-8,13-14H,5-6,9-10,12H2,1-4H3,(H,20,22)