2-[6-[[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]carbonylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[6-[[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]carbonylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[6-[[4-[(E)-thiomorpholinoiminomethyl]benzoyl]amino]tetralin-2-yl]acetic acid CAS Name: 2-[6-[[oxo-[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]methyl]amino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[6-[[4-[(E)-thiomorpholin-4-yliminomethyl]benzoyl]amino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[6-[[4-[(E)-thiomorpholinoiminomethyl]benzoyl]amino]tetralin-2-yl]acetic acid Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1CC(=O)O)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C=NN4CCSCC4

Isomeric SMILES

C1CC2=C(CC1CC(=O)O)C=CC(=C2)NC(=O)C3=CC=C(C=C3)/C=N/N4CCSCC4

InChI

InChI=1S/C24H27N3O3S/c28-23(29)14-18-3-6-21-15-22(8-7-20(21)13-18)26-24(30)19-4-1-17(2-5-19)16-25-27-9-11-31-12-10-27/h1-2,4-5,7-8,15-16,18H,3,6,9-14H2,(H,26,30)(H,28,29)/b25-16+