3-cycloheptyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-cycloheptyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-cycloheptyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-pyridylmethyl)thiourea CAS Name: 3-cycloheptyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-cycloheptyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-cycloheptyl-1-homoveratryl-1-(2-pyridylmethyl)thiourea Formula: C24H33N3O2S MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC=CC=N2)C(=S)NC3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC=CC=N2)C(=S)NC3CCCCCC3)OC

InChI

InChI=1S/C24H33N3O2S/c1-28-22-13-12-19(17-23(22)29-2)14-16-27(18-21-11-7-8-15-25-21)24(30)26-20-9-5-3-4-6-10-20/h7-8,11-13,15,17,20H,3-6,9-10,14,16,18H2,1-2H3,(H,26,30)