butyl N-[3-[(4-cyanophenyl)methyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate

Systemtic Name: butyl N-[3-[(4-cyanophenyl)methyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate Openeye Name: butyl N-[[3-[(4-cyanophenyl)methyl]-5-isobutyl-2-thienyl]sulfonyl]carbamate CAS Name: N-[[3-[(4-cyanophenyl)methyl]-5-(2-methylpropyl)-2-thiophenyl]sulfonyl]carbamic acid butyl ester IUPAC Name: butyl N-[3-[(4-cyanophenyl)methyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate Traditional Name: N-[[3-(4-cyanobenzyl)-5-isobutyl-2-thienyl]sulfonyl]carbamic acid butyl ester Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NS(=O)(=O)C1=C(C=C(S1)CC(C)C)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCOC(=O)NS(=O)(=O)C1=C(C=C(S1)CC(C)C)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H26N2O4S2/c1-4-5-10-27-21(24)23-29(25,26)20-18(13-19(28-20)11-15(2)3)12-16-6-8-17(14-22)9-7-16/h6-9,13,15H,4-5,10-12H2,1-3H3,(H,23,24)