3-cyclooctyl-1-(2-dimethylaminoethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea

Systemtic Name: 3-cyclooctyl-1-(2-dimethylaminoethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Openeye Name: 3-cyclooctyl-1-(2-dimethylaminoethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea CAS Name: 3-cyclooctyl-1-(2-dimethylaminoethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea IUPAC Name: 3-cyclooctyl-1-(2-dimethylaminoethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Traditional Name: 3-cyclooctyl-1-(2-dimethylaminoethyl)-1-(2,3,4-trimethoxybenzyl)thiourea Formula: C23H39N3O3S MolecularWeight: 437.63906

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=C(C(=C(C=C1)OC)OC)OC)C(=S)NC2CCCCCCC2

Isomeric SMILES

CN(C)CCN(CC1=C(C(=C(C=C1)OC)OC)OC)C(=S)NC2CCCCCCC2

InChI

InChI=1S/C23H39N3O3S/c1-25(2)15-16-26(23(30)24-19-11-9-7-6-8-10-12-19)17-18-13-14-20(27-3)22(29-5)21(18)28-4/h13-14,19H,6-12,15-17H2,1-5H3,(H,24,30)