2-chloranylprop-2-enyl 3-[2-(4-oxidanylidene-2-piperidin-1-yl-1,3-thiazol-5-yl)ethanoylamino]benzoate

Systemtic Name: 2-chloranylprop-2-enyl 3-[2-(4-oxidanylidene-2-piperidin-1-yl-1,3-thiazol-5-yl)ethanoylamino]benzoate Openeye Name: 2-chloroallyl 3-[[2-[4-oxo-2-(1-piperidyl)thiazol-5-yl]acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[4-oxo-2-(1-piperidinyl)-5-thiazolyl]ethyl]amino]benzoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 3-[[2-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-keto-2-piperidino-2-thiazolin-5-yl)acetyl]amino]benzoic acid 2-chloroallyl ester Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1=CC(=CC=C1)NC(=O)CC2C(=O)N=C(S2)N3CCCCC3)Cl

Isomeric SMILES

C=C(COC(=O)C1=CC(=CC=C1)NC(=O)CC2C(=O)N=C(S2)N3CCCCC3)Cl

InChI

InChI=1S/C20H22ClN3O4S/c1-13(21)12-28-19(27)14-6-5-7-15(10-14)22-17(25)11-16-18(26)23-20(29-16)24-8-3-2-4-9-24/h5-7,10,16H,1-4,8-9,11-12H2,(H,22,25)