1-(2-fluorophenyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea

Systemtic Name: 1-(2-fluorophenyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea Openeye Name: 1-(2-fluorophenyl)-3-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea CAS Name: 1-(2-fluorophenyl)-3-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-(2-fluorophenyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)thiourea Traditional Name: 1-(2-fluorophenyl)-3-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)thiourea Formula: C21H25FN4O3S2 MolecularWeight: 464.576603

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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=CC=CC=C4F

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=CC=CC=C4F

InChI

InChI=1S/C21H25FN4O3S2/c22-17-5-1-2-6-18(17)23-21(30)24-19-15-16(7-8-20(19)25-9-3-4-10-25)31(27,28)26-11-13-29-14-12-26/h1-2,5-8,15H,3-4,9-14H2,(H2,23,24,30)