1-(5-chloranyl-2-methoxy-phenyl)-3-(1-ethylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(1-ethylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(1-ethylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(1-ethyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(1-ethylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(1-ethylpiperidin-1-ium-4-yl)thiourea Formula: C15H23ClN3OS+ MolecularWeight: 328.88062

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=S)NC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=S)NC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C15H22ClN3OS/c1-3-19-8-6-12(7-9-19)17-15(21)18-13-10-11(16)4-5-14(13)20-2/h4-5,10,12H,3,6-9H2,1-2H3,(H2,17,18,21)/p+1