2-(cyanomethylsulfonyl)ethyl N-[2-acetamido-4-(diethylamino)-6-methyl-phenyl]carbamate

Systemtic Name: 2-(cyanomethylsulfonyl)ethyl N-[2-acetamido-4-(diethylamino)-6-methyl-phenyl]carbamate Openeye Name: 2-(cyanomethylsulfonyl)ethyl N-[2-acetamido-4-(diethylamino)-6-methyl-phenyl]carbamate CAS Name: N-[2-acetamido-4-(diethylamino)-6-methylphenyl]carbamic acid 2-(cyanomethylsulfonyl)ethyl ester IUPAC Name: 2-(cyanomethylsulfonyl)ethyl N-[2-acetamido-4-(diethylamino)-6-methylphenyl]carbamate Traditional Name: N-[2-acetamido-4-(diethylamino)-6-methyl-phenyl]carbamic acid 2-(cyanomethylsulfonyl)ethyl ester Formula: C18H26N4O5S MolecularWeight: 410.48784

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C(=C1)C)NC(=O)OCCS(=O)(=O)CC#N)NC(=O)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C(=C1)C)NC(=O)OCCS(=O)(=O)CC#N)NC(=O)C

InChI

InChI=1S/C18H26N4O5S/c1-5-22(6-2)15-11-13(3)17(16(12-15)20-14(4)23)21-18(24)27-8-10-28(25,26)9-7-19/h11-12H,5-6,8-10H2,1-4H3,(H,20,23)(H,21,24)