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

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(3-chloranyl-4-fluoranyl-phenyl)thiourea Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(3-chloro-4-fluoro-phenyl)thiourea CAS Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(3-chloro-4-fluorophenyl)thiourea IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(3-chloro-4-fluorophenyl)thiourea Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C20H13ClFN3S2 MolecularWeight: 413.918723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=S)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=S)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H13ClFN3S2/c21-15-11-14(8-9-16(15)22)24-20(26)23-13-5-3-4-12(10-13)19-25-17-6-1-2-7-18(17)27-19/h1-11H,(H2,23,24,26)