3-(3-chloranyl-4-fluoranyl-phenyl)-1-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(3-chloro-4-fluoro-phenyl)-1-(3-morpholinopropyl)thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-[3-(4-morpholinyl)propyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(3-chloro-4-fluorophenyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-benzyl-3-(3-chloro-4-fluoro-phenyl)-1-(3-morpholinopropyl)thiourea Formula: C21H25ClFN3OS MolecularWeight: 421.959103

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(CC2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1COCCN1CCCN(CC2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H25ClFN3OS/c22-19-15-18(7-8-20(19)23)24-21(28)26(16-17-5-2-1-3-6-17)10-4-9-25-11-13-27-14-12-25/h1-3,5-8,15H,4,9-14,16H2,(H,24,28)