5-(cyclohexen-1-yl)-3-[4-methyl-1-[(1-methylpiperidin-4-yl)carbamoyl]cyclohexyl]thiophene-2-carboxylic acid

Systemtic Name: 5-(cyclohexen-1-yl)-3-[4-methyl-1-[(1-methylpiperidin-4-yl)carbamoyl]cyclohexyl]thiophene-2-carboxylic acid Openeye Name: 5-(cyclohexen-1-yl)-3-[4-methyl-1-[(1-methyl-4-piperidyl)carbamoyl]cyclohexyl]thiophene-2-carboxylic acid CAS Name: 5-(1-cyclohexenyl)-3-[4-methyl-1-[[(1-methyl-4-piperidinyl)amino]-oxomethyl]cyclohexyl]-2-thiophenecarboxylic acid IUPAC Name: 5-(cyclohexen-1-yl)-3-[4-methyl-1-[(1-methylpiperidin-4-yl)carbamoyl]cyclohexyl]thiophene-2-carboxylic acid Traditional Name: 5-(cyclohexen-1-yl)-3-[4-methyl-1-[(1-methyl-4-piperidyl)carbamoyl]cyclohexyl]-2-thenoic acid Formula: C25H36N2O3S MolecularWeight: 444.62994

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=C(SC(=C2)C3=CCCCC3)C(=O)O)C(=O)NC4CCN(CC4)C

Isomeric SMILES

CC1CCC(CC1)(C2=C(SC(=C2)C3=CCCCC3)C(=O)O)C(=O)NC4CCN(CC4)C

InChI

InChI=1S/C25H36N2O3S/c1-17-8-12-25(13-9-17,24(30)26-19-10-14-27(2)15-11-19)20-16-21(31-22(20)23(28)29)18-6-4-3-5-7-18/h6,16-17,19H,3-5,7-15H2,1-2H3,(H,26,30)(H,28,29)