1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxypropyl)-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxypropyl)-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxypropyl)-1-(1-methyl-4-piperidyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxypropyl)-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxypropyl)-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 1-homoveratryl-3-(3-methoxypropyl)-1-(1-methyl-4-piperidyl)thiourea Formula: C21H35N3O3S MolecularWeight: 409.5859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(CCC2=CC(=C(C=C2)OC)OC)C(=S)NCCCOC

Isomeric SMILES

CN1CCC(CC1)N(CCC2=CC(=C(C=C2)OC)OC)C(=S)NCCCOC

InChI

InChI=1S/C21H35N3O3S/c1-23-12-9-18(10-13-23)24(21(28)22-11-5-15-25-2)14-8-17-6-7-19(26-3)20(16-17)27-4/h6-7,16,18H,5,8-15H2,1-4H3,(H,22,28)