(2-bromophenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonyl]-3-methyl-butan-2-yl]carbamate

Systemtic Name: (2-bromophenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonyl]-3-methyl-butan-2-yl]carbamate Openeye Name: (2-bromophenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonylmethyl]-2-methyl-propyl]carbamate CAS Name: N-[1-[1-(4-cyanophenyl)ethylsulfonyl]-3-methylbutan-2-yl]carbamic acid (2-bromophenyl) ester IUPAC Name: (2-bromophenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonyl]-3-methylbutan-2-yl]carbamate Traditional Name: N-[1-[1-(4-cyanophenyl)ethylsulfonylmethyl]-2-methyl-propyl]carbamic acid (2-bromophenyl) ester Formula: C21H23BrN2O4S MolecularWeight: 479.38732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CS(=O)(=O)C(C)C1=CC=C(C=C1)C#N)NC(=O)OC2=CC=CC=C2Br

Isomeric SMILES

CC(C)C(CS(=O)(=O)C(C)C1=CC=C(C=C1)C#N)NC(=O)OC2=CC=CC=C2Br

InChI

InChI=1S/C21H23BrN2O4S/c1-14(2)19(24-21(25)28-20-7-5-4-6-18(20)22)13-29(26,27)15(3)17-10-8-16(12-23)9-11-17/h4-11,14-15,19H,13H2,1-3H3,(H,24,25)