N-(2-methylpropyl)-1-[4-(pent-4-enoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-1-[4-(pent-4-enoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isobutyl-1-[4-(pent-4-enoylamino)cyclohexyl]triazole-4-carboxamide CAS Name: N-(2-methylpropyl)-1-[4-(1-oxopent-4-enylamino)cyclohexyl]-4-triazolecarboxamide IUPAC Name: N-(2-methylpropyl)-1-[4-(pent-4-enoylamino)cyclohexyl]triazole-4-carboxamide Traditional Name: N-isobutyl-1-[4-(pent-4-enoylamino)cyclohexyl]triazole-4-carboxamide Formula: C18H29N5O2 MolecularWeight: 347.45516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)CCC=C

Isomeric SMILES

CC(C)CNC(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)CCC=C

InChI

InChI=1S/C18H29N5O2/c1-4-5-6-17(24)20-14-7-9-15(10-8-14)23-12-16(21-22-23)18(25)19-11-13(2)3/h4,12-15H,1,5-11H2,2-3H3,(H,19,25)(H,20,24)