3-cycloheptyl-1-[(2,5-dimethoxyphenyl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 3-cycloheptyl-1-[(2,5-dimethoxyphenyl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-cycloheptyl-1-[(2,5-dimethoxyphenyl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-cycloheptyl-1-[(2,5-dimethoxyphenyl)methyl]-1-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 3-cycloheptyl-1-[(2,5-dimethoxyphenyl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 3-cycloheptyl-1-(2,5-dimethoxybenzyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C22H34N2O3S MolecularWeight: 406.58196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC2CCCO2)C(=S)NC3CCCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(C[C@H]2CCCO2)C(=S)NC3CCCCCC3

InChI

InChI=1S/C22H34N2O3S/c1-25-19-11-12-21(26-2)17(14-19)15-24(16-20-10-7-13-27-20)22(28)23-18-8-5-3-4-6-9-18/h11-12,14,18,20H,3-10,13,15-16H2,1-2H3,(H,23,28)/t20-/m1/s1