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

Systemtic Name: 1-[1-(3-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]hexan-1-one Openeye Name: 1-[1-(3-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]hexan-1-one CAS Name: 1-[1-[(3-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-1-hexanone IUPAC Name: 1-[1-(3-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]hexan-1-one Traditional Name: 1-(1-m-toluoyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl)hexan-1-one Formula: C21H30N2O2S MolecularWeight: 374.5401

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O2S/c1-3-4-5-9-19(24)22-12-10-21(11-13-22)23(14-15-26-21)20(25)18-8-6-7-17(2)16-18/h6-8,16H,3-5,9-15H2,1-2H3