5-(cyclohexen-1-yl)-3-[[1-(4,4-dimethylcyclohexyl)-4-methyl-cyclohexyl]carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-(cyclohexen-1-yl)-3-[[1-(4,4-dimethylcyclohexyl)-4-methyl-cyclohexyl]carbonylamino]thiophene-2-carboxylic acid Openeye Name: 5-(cyclohexen-1-yl)-3-[[1-(4,4-dimethylcyclohexyl)-4-methyl-cyclohexanecarbonyl]amino]thiophene-2-carboxylic acid CAS Name: 5-(1-cyclohexenyl)-3-[[[1-(4,4-dimethylcyclohexyl)-4-methylcyclohexyl]-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(cyclohexen-1-yl)-3-[[1-(4,4-dimethylcyclohexyl)-4-methylcyclohexanecarbonyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-(cyclohexen-1-yl)-3-[[1-(4,4-dimethylcyclohexyl)-4-methyl-cyclohexanecarbonyl]amino]-2-thenoic acid Formula: C27H39NO3S MolecularWeight: 457.66846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2CCC(CC2)(C)C)C(=O)NC3=C(SC(=C3)C4=CCCCC4)C(=O)O

Isomeric SMILES

CC1CCC(CC1)(C2CCC(CC2)(C)C)C(=O)NC3=C(SC(=C3)C4=CCCCC4)C(=O)O

InChI

InChI=1S/C27H39NO3S/c1-18-9-15-27(16-10-18,20-11-13-26(2,3)14-12-20)25(31)28-21-17-22(32-23(21)24(29)30)19-7-5-4-6-8-19/h7,17-18,20H,4-6,8-16H2,1-3H3,(H,28,31)(H,29,30)