3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]-2-(1,3-thiazolidin-4-ylmethylamino)propanamide

Systemtic Name: 3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]-2-(1,3-thiazolidin-4-ylmethylamino)propanamide Openeye Name: 3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]-2-(thiazolidin-4-ylmethylamino)propanamide CAS Name: 3-(cyclohexylmethylthio)-N-[(4-phenoxyphenyl)methyl]-2-(4-thiazolidinylmethylamino)propanamide IUPAC Name: 3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]-2-(1,3-thiazolidin-4-ylmethylamino)propanamide Traditional Name: 3-(cyclohexylmethylthio)-N-(4-phenoxybenzyl)-2-(thiazolidin-4-ylmethylamino)propionamide Formula: C27H37N3O2S2 MolecularWeight: 499.73158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CSCC(C(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3)NCC4CSCN4

Isomeric SMILES

C1CCC(CC1)CSCC(C(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3)NCC4CSCN4

InChI

InChI=1S/C27H37N3O2S2/c31-27(29-15-21-11-13-25(14-12-21)32-24-9-5-2-6-10-24)26(28-16-23-18-34-20-30-23)19-33-17-22-7-3-1-4-8-22/h2,5-6,9-14,22-23,26,28,30H,1,3-4,7-8,15-20H2,(H,29,31)