1-[8-(4-pentylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[8-(4-pentylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[8-(4-pentylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[8-[oxo-(4-pentylphenyl)methyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-1-propanone IUPAC Name: 1-[8-(4-pentylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[8-(4-amylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one Formula: C28H36N2O2S MolecularWeight: 464.66264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C28H36N2O2S/c1-2-3-5-8-24-11-14-25(15-12-24)27(32)29-19-17-28(18-20-29)30(21-22-33-28)26(31)16-13-23-9-6-4-7-10-23/h4,6-7,9-12,14-15H,2-3,5,8,13,16-22H2,1H3