3-(5-chloranyl-2-methoxy-phenyl)-1-(furan-2-ylmethyl)-1-[3-(3-methylpiperidin-1-yl)propyl]thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-(furan-2-ylmethyl)-1-[3-(3-methylpiperidin-1-yl)propyl]thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1-(2-furylmethyl)-1-[3-(3-methyl-1-piperidyl)propyl]thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-(2-furanylmethyl)-1-[3-(3-methyl-1-piperidinyl)propyl]thiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1-(furan-2-ylmethyl)-1-[3-(3-methylpiperidin-1-yl)propyl]thiourea Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-1-(2-furfuryl)-1-[3-(3-methylpiperidino)propyl]thiourea Formula: C22H30ClN3O2S MolecularWeight: 436.0105

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCN(CC2=CC=CO2)C(=S)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1CCCN(C1)CCCN(CC2=CC=CO2)C(=S)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C22H30ClN3O2S/c1-17-6-3-10-25(15-17)11-5-12-26(16-19-7-4-13-28-19)22(29)24-20-14-18(23)8-9-21(20)27-2/h4,7-9,13-14,17H,3,5-6,10-12,15-16H2,1-2H3,(H,24,29)