[2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2-fluorophenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone

Systemtic Name: [2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2-fluorophenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Openeye Name: [2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2-fluorophenyl)methyl]amino]methyl]thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone CAS Name: [2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2-fluorophenyl)methyl]amino]methyl]-4-thiazolyl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone IUPAC Name: [2-[[2-(3,4-dimethoxyphenyl)ethyl-[(2-fluorophenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone Traditional Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[2-[[(2-fluorobenzyl)-homoveratryl-amino]methyl]thiazol-4-yl]methanone Formula: C29H34FN3O5S MolecularWeight: 555.660763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC=CC=C2F)CC3=NC(=CS3)C(=O)N4CCC5(CC4)OCCO5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC=CC=C2F)CC3=NC(=CS3)C(=O)N4CCC5(CC4)OCCO5)OC

InChI

InChI=1S/C29H34FN3O5S/c1-35-25-8-7-21(17-26(25)36-2)9-12-32(18-22-5-3-4-6-23(22)30)19-27-31-24(20-39-27)28(34)33-13-10-29(11-14-33)37-15-16-38-29/h3-8,17,20H,9-16,18-19H2,1-2H3