1-[2,4-bis(fluoranyl)phenyl]-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea Openeye Name: 1-(2,4-difluorophenyl)-3-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea CAS Name: 1-(2,4-difluorophenyl)-3-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-(2,4-difluorophenyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)thiourea Traditional Name: 1-(2,4-difluorophenyl)-3-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)thiourea Formula: C21H24F2N4O3S2 MolecularWeight: 482.567066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C21H24F2N4O3S2/c22-15-3-5-18(17(23)13-15)24-21(31)25-19-14-16(4-6-20(19)26-7-1-2-8-26)32(28,29)27-9-11-30-12-10-27/h3-6,13-14H,1-2,7-12H2,(H2,24,25,31)