tert-butyl 2-[2-oxidanylidene-1-phenethyl-8-(4-propan-2-ylphenoxy)-4-thia-1-azaspiro[4.5]decan-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[2-oxidanylidene-1-phenethyl-8-(4-propan-2-ylphenoxy)-4-thia-1-azaspiro[4.5]decan-3-yl]ethanoate Openeye Name: tert-butyl 2-[8-(4-isopropylphenoxy)-2-oxo-1-phenethyl-4-thia-1-azaspiro[4.5]decan-3-yl]acetate CAS Name: 2-[2-oxo-1-phenethyl-8-(4-propan-2-ylphenoxy)-4-thia-1-azaspiro[4.5]decan-3-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-oxo-1-phenethyl-8-(4-propan-2-ylphenoxy)-4-thia-1-azaspiro[4.5]decan-3-yl]acetate Traditional Name: 2-[8-(4-isopropylphenoxy)-2-keto-1-phenethyl-4-thia-1-azaspiro[4.5]decan-3-yl]acetic acid tert-butyl ester Formula: C31H41NO4S MolecularWeight: 523.72654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2CCC3(CC2)N(C(=O)C(S3)CC(=O)OC(C)(C)C)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2CCC3(CC2)N(C(=O)C(S3)CC(=O)OC(C)(C)C)CCC4=CC=CC=C4

InChI

InChI=1S/C31H41NO4S/c1-22(2)24-11-13-25(14-12-24)35-26-15-18-31(19-16-26)32(20-17-23-9-7-6-8-10-23)29(34)27(37-31)21-28(33)36-30(3,4)5/h6-14,22,26-27H,15-21H2,1-5H3