1-(4-chloranyl-2,5-dimethoxy-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea

Systemtic Name: 1-(4-chloranyl-2,5-dimethoxy-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Openeye Name: 1-(4-chloro-2,5-dimethoxy-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea CAS Name: 1-(4-chloro-2,5-dimethoxyphenyl)-3-(4-methyl-1-piperazin-4-iumyl)thiourea IUPAC Name: 1-(4-chloro-2,5-dimethoxyphenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Traditional Name: 1-(4-chloro-2,5-dimethoxy-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)thiourea Formula: C14H22ClN4O2S+ MolecularWeight: 345.86808

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C14H21ClN4O2S/c1-18-4-6-19(7-5-18)17-14(22)16-11-9-12(20-2)10(15)8-13(11)21-3/h8-9H,4-7H2,1-3H3,(H2,16,17,22)/p+1