1-(phenylcarbonyl)-8-[(4-propan-2-ylphenyl)carbamoyl]-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 1-(phenylcarbonyl)-8-[(4-propan-2-ylphenyl)carbamoyl]-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 1-benzoyl-8-[(4-isopropylphenyl)carbamoyl]-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 1-benzoyl-8-[oxo-(4-propan-2-ylanilino)methyl]-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 1-benzoyl-8-[(4-propan-2-ylphenyl)carbamoyl]-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 1-benzoyl-8-(p-cumenylcarbamoyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2CCC3(CC2)N(C(CS3)C(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C2CCC3(CC2)N(C(CS3)C(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4S/c1-17(2)18-8-10-21(11-9-18)27-23(29)19-12-14-26(15-13-19)28(22(16-33-26)25(31)32)24(30)20-6-4-3-5-7-20/h3-11,17,19,22H,12-16H2,1-2H3,(H,27,29)(H,31,32)