1-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(3-chloro-4-fluoro-phenyl)thiourea CAS Name: 1-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(3-chloro-4-fluorophenyl)thiourea IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(3-chloro-4-fluorophenyl)thiourea Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C20H13ClFN3OS MolecularWeight: 397.853123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=S)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=S)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H13ClFN3OS/c21-15-11-14(9-10-16(15)22)24-20(27)23-13-7-5-12(6-8-13)19-25-17-3-1-2-4-18(17)26-19/h1-11H,(H2,23,24,27)