N-[1-[[1-[(1-cyclohexyl-5-ethyl-6-methyl-3-oxidanyl-heptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[1-[[1-[(1-cyclohexyl-5-ethyl-6-methyl-3-oxidanyl-heptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyridine-3-carboxamide Openeye Name: N-[1-benzyl-2-[[2-[[1-(cyclohexylmethyl)-4-ethyl-2-hydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]pyridine-3-carboxamide CAS Name: N-[1-[[1-[(1-cyclohexyl-5-ethyl-3-hydroxy-6-methylheptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[1-[[1-[(1-cyclohexyl-5-ethyl-3-hydroxy-6-methylheptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]pyridine-3-carboxamide Traditional Name: N-[1-benzyl-2-[[2-[[1-(cyclohexylmethyl)-4-ethyl-2-hydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-2-keto-ethyl]nicotinamide Formula: C37H52N6O4 MolecularWeight: 644.84658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(CC1CCCCC1)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CN=CC=C4)O)C(C)C

Isomeric SMILES

CCC(CC(C(CC1CCCCC1)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CN=CC=C4)O)C(C)C

InChI

InChI=1S/C37H52N6O4/c1-4-28(25(2)3)20-34(44)31(18-26-12-7-5-8-13-26)41-37(47)33(21-30-23-39-24-40-30)43-36(46)32(19-27-14-9-6-10-15-27)42-35(45)29-16-11-17-38-22-29/h6,9-11,14-17,22-26,28,31-34,44H,4-5,7-8,12-13,18-21H2,1-3H3,(H,39,40)(H,41,47)(H,42,45)(H,43,46)