tert-butyl N-[1-[1-(4-cyanophenyl)but-3-enylsulfonyl]-3-methyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[1-(4-cyanophenyl)but-3-enylsulfonyl]-3-methyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[1-(4-cyanophenyl)but-3-enylsulfonylmethyl]-2-methyl-propyl]carbamate CAS Name: N-[1-[1-(4-cyanophenyl)but-3-enylsulfonyl]-3-methylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[1-(4-cyanophenyl)but-3-enylsulfonyl]-3-methylbutan-2-yl]carbamate Traditional Name: N-[1-[1-(4-cyanophenyl)but-3-enylsulfonylmethyl]-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C21H30N2O4S MolecularWeight: 406.5389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CS(=O)(=O)C(CC=C)C1=CC=C(C=C1)C#N)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(CS(=O)(=O)C(CC=C)C1=CC=C(C=C1)C#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O4S/c1-7-8-19(17-11-9-16(13-22)10-12-17)28(25,26)14-18(15(2)3)23-20(24)27-21(4,5)6/h7,9-12,15,18-19H,1,8,14H2,2-6H3,(H,23,24)