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

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(2-methoxyethyl)thiourea Openeye Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(2-methoxyethyl)thiourea CAS Name: 1-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-(2-methoxyethyl)thiourea IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-3-(2-methoxyethyl)thiourea Formula: C16H25ClN3OS+ MolecularWeight: 342.9072

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NC1CC[NH+](CC1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

COCCNC(=S)NC1CC[NH+](CC1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H24ClN3OS/c1-21-11-8-18-16(22)19-15-6-9-20(10-7-15)12-13-2-4-14(17)5-3-13/h2-5,15H,6-12H2,1H3,(H2,18,19,22)/p+1