1-[1-(3-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]tetradecan-1-one

Systemtic Name: 1-[1-(3-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]tetradecan-1-one Openeye Name: 1-[1-(3-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]tetradecan-1-one CAS Name: 1-[1-[(3-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-1-tetradecanone IUPAC Name: 1-[1-(3-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]tetradecan-1-one Traditional Name: 1-(1-m-toluoyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl)tetradecan-1-one Formula: C29H46N2O2S MolecularWeight: 486.75274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)N1CCC2(CC1)N(CCS2)C(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N1CCC2(CC1)N(CCS2)C(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C29H46N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-17-27(32)30-20-18-29(19-21-30)31(22-23-34-29)28(33)26-16-14-15-25(2)24-26/h14-16,24H,3-13,17-23H2,1-2H3