ethyl 2-[1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-2-yl]carbonylimino-3,4-dimethyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-2-yl]carbonylimino-3,4-dimethyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[1-[(5-chloro-2-thienyl)sulfonyl]piperidine-2-carbonyl]imino-3,4-dimethyl-thiazole-5-carboxylate CAS Name: 2-[[1-[(5-chloro-2-thiophenyl)sulfonyl]-2-piperidinyl]-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(5-chlorothiophen-2-yl)sulfonylpiperidine-2-carbonyl]imino-3,4-dimethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[1-[(5-chloro-2-thienyl)sulfonyl]pipecoloyl]imino-3,4-dimethyl-4-thiazoline-5-carboxylic acid ethyl ester Formula: C18H22ClN3O5S3 MolecularWeight: 492.03238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl)S1)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl)S1)C)C

InChI

InChI=1S/C18H22ClN3O5S3/c1-4-27-17(24)15-11(2)21(3)18(29-15)20-16(23)12-7-5-6-10-22(12)30(25,26)14-9-8-13(19)28-14/h8-9,12H,4-7,10H2,1-3H3