3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylpiperidin-4-yl)-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylpiperidin-4-yl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methyl-4-piperidyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methyl-4-piperidinyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylpiperidin-4-yl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-homoveratryl-1-(1-methyl-4-piperidyl)-1-(tetrahydrofurfuryl)thiourea Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(CC2CCCO2)C(=S)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1CCC(CC1)N(CC2CCCO2)C(=S)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H35N3O3S/c1-24-12-9-18(10-13-24)25(16-19-5-4-14-28-19)22(29)23-11-8-17-6-7-20(26-2)21(15-17)27-3/h6-7,15,18-19H,4-5,8-14,16H2,1-3H3,(H,23,29)