N-cyclohex-2-en-1-yl-6-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-8-thia-6-azaspiro[3.4]octane-5-carboxamide

Systemtic Name: N-cyclohex-2-en-1-yl-6-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-8-thia-6-azaspiro[3.4]octane-5-carboxamide Openeye Name: N-cyclohex-2-en-1-yl-6-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-8-thia-6-azaspiro[3.4]octane-5-carboxamide CAS Name: N-(1-cyclohex-2-enyl)-6-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-8-thia-6-azaspiro[3.4]octane-5-carboxamide IUPAC Name: N-cyclohex-2-en-1-yl-6-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-8-thia-6-azaspiro[3.4]octane-5-carboxamide Traditional Name: N-cyclohex-2-en-1-yl-6-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-8-thia-6-azaspiro[3.4]octane-5-carboxamide Formula: C31H37N3O5S MolecularWeight: 563.70758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CSC4(C3C(=O)NC5CCCC=C5)CCC4)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CSC4(C3C(=O)NC5CCCC=C5)CCC4)O

InChI

InChI=1S/C31H37N3O5S/c1-20-23(14-8-15-25(20)35)28(37)33-24(18-21-10-4-2-5-11-21)26(36)30(39)34-19-40-31(16-9-17-31)27(34)29(38)32-22-12-6-3-7-13-22/h2,4-6,8,10-12,14-15,22,24,26-27,35-36H,3,7,9,13,16-19H2,1H3,(H,32,38)(H,33,37)