3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(4-chloro-2-methoxy-5-methyl-phenyl)-1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-(4-chloro-2-methoxy-5-methylphenyl)-1-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(4-chloro-2-methoxy-5-methylphenyl)-1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(4-chloro-2-methoxy-5-methyl-phenyl)-1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-1-(2-thenyl)thiourea Formula: C23H33ClN3OS2+ MolecularWeight: 467.11062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCN(CC2=CC=CS2)C(=S)NC3=C(C=C(C(=C3)C)Cl)OC

Isomeric SMILES

CC1CC[NH+](CC1)CCCN(CC2=CC=CS2)C(=S)NC3=C(C=C(C(=C3)C)Cl)OC

InChI

InChI=1S/C23H32ClN3OS2/c1-17-7-11-26(12-8-17)9-5-10-27(16-19-6-4-13-30-19)23(29)25-21-14-18(2)20(24)15-22(21)28-3/h4,6,13-15,17H,5,7-12,16H2,1-3H3,(H,25,29)/p+1