1-[2-[[5-(diethylcarbamoyl)-3-ethoxycarbonyl-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[[5-(diethylcarbamoyl)-3-ethoxycarbonyl-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[[5-(diethylcarbamoyl)-3-ethoxycarbonyl-4-methyl-2-thienyl]amino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[[5-[diethylamino(oxo)methyl]-3-ethoxycarbonyl-4-methyl-2-thiophenyl]amino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[[5-(diethylcarbamoyl)-3-ethoxycarbonyl-4-methylthiophen-2-yl]amino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[[3-carbethoxy-5-(diethylcarbamoyl)-4-methyl-2-thienyl]amino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C23H34N2O6S MolecularWeight: 466.59086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC2(CCCCCC2)C(=O)O)C(=O)OCC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC2(CCCCCC2)C(=O)O)C(=O)OCC)C

InChI

InChI=1S/C23H34N2O6S/c1-5-25(6-2)20(27)18-15(4)17(21(28)31-7-3)19(32-18)24-16(26)14-23(22(29)30)12-10-8-9-11-13-23/h5-14H2,1-4H3,(H,24,26)(H,29,30)