tert-butyl 4-acetamido-5-oxidanylidene-5-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)pentanoate

Systemtic Name: tert-butyl 4-acetamido-5-oxidanylidene-5-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)pentanoate Openeye Name: tert-butyl 4-acetamido-5-oxo-5-[8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decan-3-yl]pentanoate CAS Name: 4-acetamido-5-oxo-5-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-acetamido-5-oxo-5-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)pentanoate Traditional Name: 4-acetamido-5-keto-5-[8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decan-3-yl]valeric acid tert-butyl ester Formula: C23H35N3O6S2 MolecularWeight: 513.6705

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)OC(C)(C)C)C(=O)N1CCC2(C1)CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CCC(=O)OC(C)(C)C)C(=O)N1CCC2(C1)CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C23H35N3O6S2/c1-17(27)24-18(7-8-19(28)32-22(2,3)4)21(29)25-12-9-23(16-25)10-13-26(14-11-23)34(30,31)20-6-5-15-33-20/h5-6,15,18H,7-14,16H2,1-4H3,(H,24,27)