1-(1,3-benzodioxol-5-ylmethyl)-1-[[(2R)-oxolan-2-yl]methyl]-3-pyridin-3-yl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(2R)-oxolan-2-yl]methyl]-3-pyridin-3-yl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-pyridyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(2R)-2-oxolanyl]methyl]-3-(3-pyridinyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(2R)-oxolan-2-yl]methyl]-3-pyridin-3-ylthiourea Traditional Name: 1-piperonyl-3-(3-pyridyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4=CN=CC=C4

Isomeric SMILES

C1C[C@@H](OC1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4=CN=CC=C4

InChI

InChI=1S/C19H21N3O3S/c26-19(21-15-3-1-7-20-10-15)22(12-16-4-2-8-23-16)11-14-5-6-17-18(9-14)25-13-24-17/h1,3,5-7,9-10,16H,2,4,8,11-13H2,(H,21,26)/t16-/m1/s1