1-(4-bromanyl-2-chloranyl-phenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(1-propyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Formula: C15H22BrClN3S+ MolecularWeight: 391.77728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21BrClN3S/c1-2-7-20-8-5-12(6-9-20)18-15(21)19-14-4-3-11(16)10-13(14)17/h3-4,10,12H,2,5-9H2,1H3,(H2,18,19,21)/p+1