1-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]urea

Systemtic Name: 1-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]urea Openeye Name: 1-[(4-fluoro-3-methyl-phenyl)methyl]-3-[(5-morpholinosulfonyl-2-thienyl)methyl]urea CAS Name: 1-[(4-fluoro-3-methylphenyl)methyl]-3-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]urea IUPAC Name: 1-[(4-fluoro-3-methylphenyl)methyl]-3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]urea Traditional Name: 1-(4-fluoro-3-methyl-benzyl)-3-[(5-morpholinosulfonyl-2-thienyl)methyl]urea Formula: C18H22FN3O4S2 MolecularWeight: 427.513383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C18H22FN3O4S2/c1-13-10-14(2-4-16(13)19)11-20-18(23)21-12-15-3-5-17(27-15)28(24,25)22-6-8-26-9-7-22/h2-5,10H,6-9,11-12H2,1H3,(H2,20,21,23)