sodium 5-[[3-(cyclohexylmethylcarbamoyl)-4-methoxy-phenyl]methyl]-4-oxidanylidene-1,3-thiazol-2-olate

Systemtic Name: sodium 5-[[3-(cyclohexylmethylcarbamoyl)-4-methoxy-phenyl]methyl]-4-oxidanylidene-1,3-thiazol-2-olate Openeye Name: sodium 5-[[3-(cyclohexylmethylcarbamoyl)-4-methoxy-phenyl]methyl]-4-oxo-thiazol-2-olate CAS Name: sodium 5-[[3-[(cyclohexylmethylamino)-oxomethyl]-4-methoxyphenyl]methyl]-4-oxo-2-thiazololate IUPAC Name: sodium 5-[[3-(cyclohexylmethylcarbamoyl)-4-methoxyphenyl]methyl]-4-oxo-1,3-thiazol-2-olate Traditional Name: sodium 5-[3-(cyclohexylmethylcarbamoyl)-4-methoxy-benzyl]-4-keto-2-thiazolin-2-olate Formula: C19H23N2NaO4S MolecularWeight: 398.45169

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2C(=O)N=C(S2)[O-])C(=O)NCC3CCCCC3.[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)CC2C(=O)N=C(S2)[O-])C(=O)NCC3CCCCC3.[Na+]

InChI

InChI=1S/C19H24N2O4S.Na/c1-25-15-8-7-13(10-16-18(23)21-19(24)26-16)9-14(15)17(22)20-11-12-5-3-2-4-6-12;/h7-9,12,16H,2-6,10-11H2,1H3,(H,20,22)(H,21,23,24);/q;+1/p-1