1-(furan-2-ylmethyl)-3-(4-phenoxyphenyl)-1-(3-piperidin-1-ylpropyl)thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-(4-phenoxyphenyl)-1-(3-piperidin-1-ylpropyl)thiourea Openeye Name: 1-(2-furylmethyl)-3-(4-phenoxyphenyl)-1-[3-(1-piperidyl)propyl]thiourea CAS Name: 1-(2-furanylmethyl)-3-(4-phenoxyphenyl)-1-[3-(1-piperidinyl)propyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-(4-phenoxyphenyl)-1-(3-piperidin-1-ylpropyl)thiourea Traditional Name: 1-(2-furfuryl)-3-(4-phenoxyphenyl)-1-(3-piperidinopropyl)thiourea Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN(CC2=CC=CO2)C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCCN(CC2=CC=CO2)C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2S/c32-26(27-22-12-14-24(15-13-22)31-23-9-3-1-4-10-23)29(21-25-11-7-20-30-25)19-8-18-28-16-5-2-6-17-28/h1,3-4,7,9-15,20H,2,5-6,8,16-19,21H2,(H,27,32)