1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(2-furylmethyl)thiourea CAS Name: 1-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-3-(2-furfuryl)thiourea Formula: C18H23ClN3OS+ MolecularWeight: 364.91272

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=S)NCC2=CC=CO2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=S)NCC2=CC=CO2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H22ClN3OS/c19-15-5-3-14(4-6-15)13-22-9-7-16(8-10-22)21-18(24)20-12-17-2-1-11-23-17/h1-6,11,16H,7-10,12-13H2,(H2,20,21,24)/p+1