methyl 1-(2-methyl-3-sulfanyl-propanoyl)-8-phenyl-4-thia-1-azaspiro[4.5]decane-2-carboxylate

Systemtic Name: methyl 1-(2-methyl-3-sulfanyl-propanoyl)-8-phenyl-4-thia-1-azaspiro[4.5]decane-2-carboxylate Openeye Name: methyl 1-(2-methyl-3-sulfanyl-propanoyl)-8-phenyl-4-thia-1-azaspiro[4.5]decane-2-carboxylate CAS Name: 1-(3-mercapto-2-methyl-1-oxopropyl)-8-phenyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid methyl ester IUPAC Name: methyl 1-(2-methyl-3-sulfanylpropanoyl)-8-phenyl-4-thia-1-azaspiro[4.5]decane-2-carboxylate Traditional Name: 1-(3-mercapto-2-methyl-propanoyl)-8-phenyl-4-thia-1-azaspiro[4.5]decane-2-carboxylic acid methyl ester Formula: C20H27NO3S2 MolecularWeight: 393.56328

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1C(CSC12CCC(CC2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(CS)C(=O)N1C(CSC12CCC(CC2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H27NO3S2/c1-14(12-25)18(22)21-17(19(23)24-2)13-26-20(21)10-8-16(9-11-20)15-6-4-3-5-7-15/h3-7,14,16-17,25H,8-13H2,1-2H3