methyl 2-[2-[(5R)-2-(2-cycloheptylidenehydrazinyl)-4-oxidanylidene-1,3-thiazol-5-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(5R)-2-(2-cycloheptylidenehydrazinyl)-4-oxidanylidene-1,3-thiazol-5-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(5R)-2-(2-cycloheptylidenehydrazino)-4-oxo-thiazol-5-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[(5R)-2-(2-cycloheptylidenehydrazinyl)-4-oxo-5-thiazolyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(5R)-2-(2-cycloheptylidenehydrazinyl)-4-oxo-1,3-thiazol-5-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[(5R)-2-(N'-cycloheptylidenehydrazino)-4-keto-2-thiazolin-5-yl]acetyl]amino]benzoic acid methyl ester Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CC2C(=O)N=C(S2)NN=C3CCCCCC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C[C@@H]2C(=O)N=C(S2)NN=C3CCCCCC3

InChI

InChI=1S/C20H24N4O4S/c1-28-19(27)14-10-6-7-11-15(14)21-17(25)12-16-18(26)22-20(29-16)24-23-13-8-4-2-3-5-9-13/h6-7,10-11,16H,2-5,8-9,12H2,1H3,(H,21,25)(H,22,24,26)/t16-/m1/s1