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

Systemtic Name: 1-[8-(4-hexylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[8-(4-hexylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[8-[(4-hexylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-1-propanone IUPAC Name: 1-[8-(4-hexylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[8-(4-hexylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-phenyl-propan-1-one Formula: C29H38N2O2S MolecularWeight: 478.68922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C29H38N2O2S/c1-2-3-4-6-11-25-12-15-26(16-13-25)28(33)30-20-18-29(19-21-30)31(22-23-34-29)27(32)17-14-24-9-7-5-8-10-24/h5,7-10,12-13,15-16H,2-4,6,11,14,17-23H2,1H3