8-(4-propan-2-ylphenoxy)-1-pyrazin-2-ylcarbonyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 8-(4-propan-2-ylphenoxy)-1-pyrazin-2-ylcarbonyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 8-(4-isopropylphenoxy)-1-(pyrazine-2-carbonyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 1-[oxo(2-pyrazinyl)methyl]-8-(4-propan-2-ylphenoxy)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 8-(4-propan-2-ylphenoxy)-1-(pyrazine-2-carbonyl)-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 8-(4-isopropylphenoxy)-1-pyrazinoyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2CCC3(CC2)N(C(CS3)C(=O)O)C(=O)C4=NC=CN=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2CCC3(CC2)N(C(CS3)C(=O)O)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C23H27N3O4S/c1-15(2)16-3-5-17(6-4-16)30-18-7-9-23(10-8-18)26(20(14-31-23)22(28)29)21(27)19-13-24-11-12-25-19/h3-6,11-13,15,18,20H,7-10,14H2,1-2H3,(H,28,29)