1-[1-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[1-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-butan-1-one Openeye Name: 1-[1-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-butan-1-one CAS Name: 1-[1-[(2-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-1-butanone IUPAC Name: 1-[1-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenylbutan-1-one Traditional Name: 1-(1-o-toluoyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl)-2-phenyl-butan-1-one Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C25H30N2O2S/c1-3-21(20-10-5-4-6-11-20)23(28)26-15-13-25(14-16-26)27(17-18-30-25)24(29)22-12-8-7-9-19(22)2/h4-12,21H,3,13-18H2,1-2H3