3-(5-chloranyl-2-methoxy-phenyl)-1-[[(2R)-oxolan-2-yl]methyl]-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-[[(2R)-oxolan-2-yl]methyl]-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1-(4-pyridylmethyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-[[(2R)-2-oxolanyl]methyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1-[[(2R)-oxolan-2-yl]methyl]-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-1-(4-pyridylmethyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C19H22ClN3O2S MolecularWeight: 391.91488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)N(CC2CCCO2)CC3=CC=NC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)N(C[C@H]2CCCO2)CC3=CC=NC=C3

InChI

InChI=1S/C19H22ClN3O2S/c1-24-18-5-4-15(20)11-17(18)22-19(26)23(13-16-3-2-10-25-16)12-14-6-8-21-9-7-14/h4-9,11,16H,2-3,10,12-13H2,1H3,(H,22,26)/t16-/m1/s1