(4-methylphenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonyl]butan-2-yl]carbamate

Systemtic Name: (4-methylphenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonyl]butan-2-yl]carbamate Openeye Name: p-tolyl N-[1-[1-(4-cyanophenyl)ethylsulfonylmethyl]propyl]carbamate CAS Name: N-[1-[1-(4-cyanophenyl)ethylsulfonyl]butan-2-yl]carbamic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) N-[1-[1-(4-cyanophenyl)ethylsulfonyl]butan-2-yl]carbamate Traditional Name: N-[1-[1-(4-cyanophenyl)ethylsulfonylmethyl]propyl]carbamic acid p-tolyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CS(=O)(=O)C(C)C1=CC=C(C=C1)C#N)NC(=O)OC2=CC=C(C=C2)C

Isomeric SMILES

CCC(CS(=O)(=O)C(C)C1=CC=C(C=C1)C#N)NC(=O)OC2=CC=C(C=C2)C

InChI

InChI=1S/C21H24N2O4S/c1-4-19(23-21(24)27-20-11-5-15(2)6-12-20)14-28(25,26)16(3)18-9-7-17(13-22)8-10-18/h5-12,16,19H,4,14H2,1-3H3,(H,23,24)