8-(5-azanyl-5-oxidanylidene-pentylidene)-1-(phenylcarbonyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 8-(5-azanyl-5-oxidanylidene-pentylidene)-1-(phenylcarbonyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 8-(5-amino-5-oxo-pentylidene)-1-benzoyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 8-(5-amino-5-oxopentylidene)-1-benzoyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 8-(5-amino-5-oxopentylidene)-1-benzoyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 8-(5-amino-5-keto-pentylidene)-1-benzoyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1=CCCCC(=O)N)N(C(CS2)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC2(CCC1=CCCCC(=O)N)N(C(CS2)C(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c22-18(24)9-5-4-6-15-10-12-21(13-11-15)23(17(14-28-21)20(26)27)19(25)16-7-2-1-3-8-16/h1-3,6-8,17H,4-5,9-14H2,(H2,22,24)(H,26,27)