1-(3-chloranyl-4-fluoranyl-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(4-phenyl-1-piperazinyl)propyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[3-(4-phenylpiperazino)propyl]thiourea Formula: C20H24ClFN4S MolecularWeight: 406.947763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=S)NC2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCNC(=S)NC2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H24ClFN4S/c21-18-15-16(7-8-19(18)22)24-20(27)23-9-4-10-25-11-13-26(14-12-25)17-5-2-1-3-6-17/h1-3,5-8,15H,4,9-14H2,(H2,23,24,27)