2-cycloheptyl-3-[oxidanyl(phenyl)methyl]-8-thia-2,4-diazaspiro[4.5]dec-3-en-1-one

Systemtic Name: 2-cycloheptyl-3-[oxidanyl(phenyl)methyl]-8-thia-2,4-diazaspiro[4.5]dec-3-en-1-one Openeye Name: 2-cycloheptyl-3-[hydroxy(phenyl)methyl]-8-thia-2,4-diazaspiro[4.5]dec-3-en-1-one CAS Name: 2-cycloheptyl-3-[hydroxy(phenyl)methyl]-8-thia-2,4-diazaspiro[4.5]dec-3-en-1-one IUPAC Name: 2-cycloheptyl-3-[hydroxy(phenyl)methyl]-8-thia-2,4-diazaspiro[4.5]dec-3-en-1-one Traditional Name: 2-cycloheptyl-3-[hydroxy(phenyl)methyl]-8-thia-2,4-diazaspiro[4.5]dec-3-en-1-one Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2C(=NC3(C2=O)CCSCC3)C(C4=CC=CC=C4)O

Isomeric SMILES

C1CCCC(CC1)N2C(=NC3(C2=O)CCSCC3)C(C4=CC=CC=C4)O

InChI

InChI=1S/C21H28N2O2S/c24-18(16-8-4-3-5-9-16)19-22-21(12-14-26-15-13-21)20(25)23(19)17-10-6-1-2-7-11-17/h3-5,8-9,17-18,24H,1-2,6-7,10-15H2