2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 2-(4-methyl-2-oxo-thiazol-3-yl)ethyl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid 2-(4-methyl-2-oxo-3-thiazolyl)ethyl ester IUPAC Name: 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid 2-(2-keto-4-methyl-4-thiazolin-3-yl)ethyl ester Formula: C18H21ClN2O5S2 MolecularWeight: 444.95274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CCOC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC1=CSC(=O)N1CCOC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C18H21ClN2O5S2/c1-13-12-27-18(23)21(13)9-10-26-17(22)15-11-14(5-6-16(15)19)28(24,25)20-7-3-2-4-8-20/h5-6,11-12H,2-4,7-10H2,1H3