1-[[4-(4-fluoranylphenoxy)phenyl]methyl]-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-(oxan-4-yl)urea

Systemtic Name: 1-[[4-(4-fluoranylphenoxy)phenyl]methyl]-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-(oxan-4-yl)urea Openeye Name: 1-[[4-(4-fluorophenoxy)phenyl]methyl]-3-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-1-tetrahydropyran-4-yl-urea CAS Name: 1-[[4-(4-fluorophenoxy)phenyl]methyl]-3-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-1-(4-oxanyl)urea IUPAC Name: 1-[[4-(4-fluorophenoxy)phenyl]methyl]-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-(oxan-4-yl)urea Traditional Name: 1-[4-(4-fluorophenoxy)benzyl]-3-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-1-tetrahydropyran-4-yl-urea Formula: C27H30FN3O3S2 MolecularWeight: 527.673803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C4CCOCC4)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C4CCOCC4)SC

InChI

InChI=1S/C27H30FN3O3S2/c1-18-16-24(35-2)25(26(29-18)36-3)30-27(32)31(21-12-14-33-15-13-21)17-19-4-8-22(9-5-19)34-23-10-6-20(28)7-11-23/h4-11,16,21H,12-15,17H2,1-3H3,(H,30,32)