1-ethyl-3-[[3-[4-[2-methyl-5-(propan-2-ylcarbamoylamino)pentan-2-yl]-2-oxidanyl-phenyl]phenyl]methyl]urea

Systemtic Name: 1-ethyl-3-[[3-[4-[2-methyl-5-(propan-2-ylcarbamoylamino)pentan-2-yl]-2-oxidanyl-phenyl]phenyl]methyl]urea Openeye Name: 1-ethyl-3-[[3-[2-hydroxy-4-[4-(isopropylcarbamoylamino)-1,1-dimethyl-butyl]phenyl]phenyl]methyl]urea CAS Name: 1-ethyl-3-[[3-[2-hydroxy-4-[2-methyl-5-[[oxo-(propan-2-ylamino)methyl]amino]pentan-2-yl]phenyl]phenyl]methyl]urea IUPAC Name: 1-ethyl-3-[[3-[2-hydroxy-4-[2-methyl-5-(propan-2-ylcarbamoylamino)pentan-2-yl]phenyl]phenyl]methyl]urea Traditional Name: 1-ethyl-3-[3-[2-hydroxy-4-[4-(isopropylcarbamoylamino)-1,1-dimethyl-butyl]phenyl]benzyl]urea Formula: C26H38N4O3 MolecularWeight: 454.60492

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NCC1=CC=CC(=C1)C2=C(C=C(C=C2)C(C)(C)CCCNC(=O)NC(C)C)O

Isomeric SMILES

CCNC(=O)NCC1=CC=CC(=C1)C2=C(C=C(C=C2)C(C)(C)CCCNC(=O)NC(C)C)O

InChI

InChI=1S/C26H38N4O3/c1-6-27-24(32)29-17-19-9-7-10-20(15-19)22-12-11-21(16-23(22)31)26(4,5)13-8-14-28-25(33)30-18(2)3/h7,9-12,15-16,18,31H,6,8,13-14,17H2,1-5H3,(H2,27,29,32)(H2,28,30,33)