ethyl 5-[[1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-2-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[1-(5-chloranylthiophen-2-yl)sulfonylpiperidin-2-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[1-[(5-chloro-2-thienyl)sulfonyl]piperidine-2-carbonyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[1-[(5-chloro-2-thiophenyl)sulfonyl]-2-piperidinyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(5-chlorothiophen-2-yl)sulfonylpiperidine-2-carbonyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[1-[(5-chloro-2-thienyl)sulfonyl]pipecoloyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H21ClN2O5S3 MolecularWeight: 477.01774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2O5S3/c1-3-26-18(23)16-11(2)10-14(28-16)20-17(22)12-6-4-5-9-21(12)29(24,25)15-8-7-13(19)27-15/h7-8,10,12H,3-6,9H2,1-2H3,(H,20,22)