1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-chloro-5-morpholinosulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-chloro-5-morpholinosulfonyl-phenyl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C18H17ClF3N3O3S2 MolecularWeight: 479.92409

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H17ClF3N3O3S2/c19-15-5-4-14(30(26,27)25-6-8-28-9-7-25)11-16(15)24-17(29)23-13-3-1-2-12(10-13)18(20,21)22/h1-5,10-11H,6-9H2,(H2,23,24,29)