5-[1-(aminocarbonylamino)-4-cyclopentyl-6-morpholin-4-yl-hexyl]-N-(2-aminophenyl)pyridine-2-carboxamide

Systemtic Name: 5-[1-(aminocarbonylamino)-4-cyclopentyl-6-morpholin-4-yl-hexyl]-N-(2-aminophenyl)pyridine-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-(4-cyclopentyl-6-morpholino-1-ureido-hexyl)pyridine-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[1-(carbamoylamino)-4-cyclopentyl-6-(4-morpholinyl)hexyl]-2-pyridinecarboxamide IUPAC Name: N-(2-aminophenyl)-5-[1-(carbamoylamino)-4-cyclopentyl-6-morpholin-4-ylhexyl]pyridine-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-(4-cyclopentyl-6-morpholino-1-ureido-hexyl)picolinamide Formula: C28H40N6O3 MolecularWeight: 508.6556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(CCC(C2=CN=C(C=C2)C(=O)NC3=CC=CC=C3N)NC(=O)N)CCN4CCOCC4

Isomeric SMILES

C1CCC(C1)C(CCC(C2=CN=C(C=C2)C(=O)NC3=CC=CC=C3N)NC(=O)N)CCN4CCOCC4

InChI

InChI=1S/C28H40N6O3/c29-23-7-3-4-8-25(23)32-27(35)26-12-10-22(19-31-26)24(33-28(30)36)11-9-21(20-5-1-2-6-20)13-14-34-15-17-37-18-16-34/h3-4,7-8,10,12,19-21,24H,1-2,5-6,9,11,13-18,29H2,(H,32,35)(H3,30,33,36)