3-[5-azanyl-2-methyl-7,8-bis(oxidanyl)-4-oxidanylidene-5,10-diphenyl-decan-3-yl]-1-methyl-1-(pyridin-2-ylmethyl)urea

Systemtic Name: 3-[5-azanyl-2-methyl-7,8-bis(oxidanyl)-4-oxidanylidene-5,10-diphenyl-decan-3-yl]-1-methyl-1-(pyridin-2-ylmethyl)urea Openeye Name: 3-(3-amino-5,6-dihydroxy-1-isopropyl-2-oxo-3,8-diphenyl-octyl)-1-methyl-1-(2-pyridylmethyl)urea CAS Name: 3-(5-amino-7,8-dihydroxy-2-methyl-4-oxo-5,10-diphenyldecan-3-yl)-1-methyl-1-(2-pyridinylmethyl)urea IUPAC Name: 3-(5-amino-7,8-dihydroxy-2-methyl-4-oxo-5,10-diphenyldecan-3-yl)-1-methyl-1-(pyridin-2-ylmethyl)urea Traditional Name: 3-(3-amino-5,6-dihydroxy-1-isopropyl-2-keto-3,8-diphenyl-octyl)-1-methyl-1-(2-pyridylmethyl)urea Formula: C31H40N4O4 MolecularWeight: 532.6737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(CC(C(CCC1=CC=CC=C1)O)O)(C2=CC=CC=C2)N)NC(=O)N(C)CC3=CC=CC=N3

Isomeric SMILES

CC(C)C(C(=O)C(CC(C(CCC1=CC=CC=C1)O)O)(C2=CC=CC=C2)N)NC(=O)N(C)CC3=CC=CC=N3

InChI

InChI=1S/C31H40N4O4/c1-22(2)28(34-30(39)35(3)21-25-16-10-11-19-33-25)29(38)31(32,24-14-8-5-9-15-24)20-27(37)26(36)18-17-23-12-6-4-7-13-23/h4-16,19,22,26-28,36-37H,17-18,20-21,32H2,1-3H3,(H,34,39)