3-(3-chloranyl-4-fluoranyl-phenyl)-1-[(3-methoxy-4-propoxy-phenyl)methyl]-1-propyl-thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-[(3-methoxy-4-propoxy-phenyl)methyl]-1-propyl-thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-[(3-methoxy-4-propoxy-phenyl)methyl]-1-propyl-thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-[(3-methoxy-4-propoxyphenyl)methyl]-1-propylthiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-[(3-methoxy-4-propoxyphenyl)methyl]-1-propylthiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-(3-methoxy-4-propoxy-benzyl)-1-propyl-thiourea Formula: C21H26ClFN2O2S MolecularWeight: 424.959743

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=C(C=C1)OCCC)OC)C(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCCN(CC1=CC(=C(C=C1)OCCC)OC)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C21H26ClFN2O2S/c1-4-10-25(21(28)24-16-7-8-18(23)17(22)13-16)14-15-6-9-19(27-11-5-2)20(12-15)26-3/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H,24,28)