N-[1-[(3-cyano-1-cyclohexyl-pyrrolidin-3-yl)amino]-3-(4-iodophenyl)-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[1-[(3-cyano-1-cyclohexyl-pyrrolidin-3-yl)amino]-3-(4-iodophenyl)-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[2-[(3-cyano-1-cyclohexyl-pyrrolidin-3-yl)amino]-1-[(4-iodophenyl)methyl]-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[1-[(3-cyano-1-cyclohexyl-3-pyrrolidinyl)amino]-3-(4-iodophenyl)-1-oxopropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[1-[(3-cyano-1-cyclohexylpyrrolidin-3-yl)amino]-3-(4-iodophenyl)-1-oxopropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[2-[(3-cyano-1-cyclohexyl-pyrrolidin-3-yl)amino]-1-(4-iodobenzyl)-2-keto-ethyl]morpholine-4-carboxamide Formula: C25H34IN5O3 MolecularWeight: 579.47363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCC(C2)(C#N)NC(=O)C(CC3=CC=C(C=C3)I)NC(=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)N2CCC(C2)(C#N)NC(=O)C(CC3=CC=C(C=C3)I)NC(=O)N4CCOCC4

InChI

InChI=1S/C25H34IN5O3/c26-20-8-6-19(7-9-20)16-22(28-24(33)30-12-14-34-15-13-30)23(32)29-25(17-27)10-11-31(18-25)21-4-2-1-3-5-21/h6-9,21-22H,1-5,10-16,18H2,(H,28,33)(H,29,32)