tert-butyl N-[(E)-5-cyano-1-thiophen-2-yl-pent-1-enyl]-N-[(2-methylpropan-2-yl)oxycarbonylamino]carbamate

Systemtic Name: tert-butyl N-[(E)-5-cyano-1-thiophen-2-yl-pent-1-enyl]-N-[(2-methylpropan-2-yl)oxycarbonylamino]carbamate Openeye Name: tert-butyl N-(tert-butoxycarbonylamino)-N-[(E)-5-cyano-1-(2-thienyl)pent-1-enyl]carbamate CAS Name: N-[(E)-5-cyano-1-thiophen-2-ylpent-1-enyl]-N-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-5-cyano-1-thiophen-2-ylpent-1-enyl]-N-[(2-methylpropan-2-yl)oxycarbonylamino]carbamate Traditional Name: N-(tert-butoxycarbonylamino)-N-[(E)-5-cyano-1-(2-thienyl)pent-1-enyl]carbamic acid tert-butyl ester Formula: C20H29N3O4S MolecularWeight: 407.52696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(C(=CCCCC#N)C1=CC=CS1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NN(/C(=C/CCCC#N)/C1=CC=CS1)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H29N3O4S/c1-19(2,3)26-17(24)22-23(18(25)27-20(4,5)6)15(11-8-7-9-13-21)16-12-10-14-28-16/h10-12,14H,7-9H2,1-6H3,(H,22,24)/b15-11+