methyl 2-[[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[1-[(E)-styryl]sulfonylpiperidine-4-carbonyl]amino]thiazole-5-carboxylate CAS Name: 2-[[oxo-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carbonyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[1-[(E)-styryl]sulfonylisonipecotoyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C19H21N3O5S2 MolecularWeight: 435.51714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O5S2/c1-27-18(24)16-13-20-19(28-16)21-17(23)15-7-10-22(11-8-15)29(25,26)12-9-14-5-3-2-4-6-14/h2-6,9,12-13,15H,7-8,10-11H2,1H3,(H,20,21,23)/b12-9+