2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]-1-[(5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]-1-[(5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]-1-[(5-methyl-2-thienyl)carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]-1-[[(5-methyl-2-thiophenyl)amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]-1-[(5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[(3-chloro-4-methoxy-benzyl)carbamoyl]-1-[(5-methyl-2-thienyl)carbamoyl]cyclohexanecarboxylic acid Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)NC(=O)C2(CCCCC2C(=O)NCC3=CC(=C(C=C3)OC)Cl)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)NC(=O)C2(CCCCC2C(=O)NCC3=CC(=C(C=C3)OC)Cl)C(=O)O

InChI

InChI=1S/C22H25ClN2O5S/c1-13-6-9-18(31-13)25-20(27)22(21(28)29)10-4-3-5-15(22)19(26)24-12-14-7-8-17(30-2)16(23)11-14/h6-9,11,15H,3-5,10,12H2,1-2H3,(H,24,26)(H,25,27)(H,28,29)