ethyl (2S)-1-(benzamidosulfanylmethylimino)spiro[2,4-dihydronaphthalene-3,1'-cyclohexane]-2-carboxylate

Systemtic Name: ethyl (2S)-1-(benzamidosulfanylmethylimino)spiro[2,4-dihydronaphthalene-3,1'-cyclohexane]-2-carboxylate Openeye Name: ethyl (2'S)-1'-(benzamidosulfanylmethylimino)spiro[cyclohexane-1,3'-tetralin]-2'-carboxylate CAS Name: (2S)-1-[(benzamidothio)methylimino]-2-spiro[2,4-dihydronaphthalene-3,1'-cyclohexane]carboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-(benzamidosulfanylmethylimino)spiro[2,4-dihydronaphthalene-3,1'-cyclohexane]-2-carboxylate Traditional Name: (2'S)-1'-[(benzamidothio)methylimino]spiro[cyclohexane-1,3'-tetralin]-2'-carboxylic acid ethyl ester Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=NCSNC(=O)C2=CC=CC=C2)C3=CC=CC=C3CC14CCCCC4

Isomeric SMILES

CCOC(=O)[C@@H]1C(=NCSNC(=O)C2=CC=CC=C2)C3=CC=CC=C3CC14CCCCC4

InChI

InChI=1S/C26H30N2O3S/c1-2-31-25(30)22-23(27-18-32-28-24(29)19-11-5-3-6-12-19)21-14-8-7-13-20(21)17-26(22)15-9-4-10-16-26/h3,5-8,11-14,22H,2,4,9-10,15-18H2,1H3,(H,28,29)/t22-/m0/s1