1-(3-chloranyl-4-fluoranyl-phenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1-isopropylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(1-propan-2-yl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1-isopropylpiperidin-1-ium-4-yl)thiourea Formula: C15H22ClFN3S+ MolecularWeight: 330.871683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClFN3S/c1-10(2)20-7-5-11(6-8-20)18-15(21)19-12-3-4-14(17)13(16)9-12/h3-4,9-11H,5-8H2,1-2H3,(H2,18,19,21)/p+1