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

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-phenethyl-thiourea Openeye Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-phenethyl-thiourea CAS Name: 1-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-phenethylthiourea IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-phenethylthiourea Traditional Name: 1-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-3-phenethyl-thiourea Formula: C21H27ClN3S+ MolecularWeight: 388.97718

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=S)NCCC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=S)NCCC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN3S/c22-19-8-6-18(7-9-19)16-25-14-11-20(12-15-25)24-21(26)23-13-10-17-4-2-1-3-5-17/h1-9,20H,10-16H2,(H2,23,24,26)/p+1