1-(4-chlorophenyl)-3-[3-(4-phenylpiperazin-1-ium-1-yl)propyl]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[3-(4-phenylpiperazin-1-ium-1-yl)propyl]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[3-(4-phenylpiperazin-1-ium-1-yl)propyl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[3-(4-phenyl-1-piperazin-1-iumyl)propyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[3-(4-phenylpiperazin-1-ium-1-yl)propyl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[3-(4-phenylpiperazin-1-ium-1-yl)propyl]thiourea Formula: C20H26ClN4S+ MolecularWeight: 389.96524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC(=S)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCCNC(=S)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H25ClN4S/c21-17-7-9-18(10-8-17)23-20(26)22-11-4-12-24-13-15-25(16-14-24)19-5-2-1-3-6-19/h1-3,5-10H,4,11-16H2,(H2,22,23,26)/p+1