2-[1-[2-[(3-aminocarbonyl-5-methyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[2-[(3-aminocarbonyl-5-methyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[2-[(3-carbamoyl-5-methyl-4-phenyl-2-thienyl)amino]-2-oxo-ethyl]cyclohexyl]acetic acid CAS Name: 2-[1-[2-[(3-carbamoyl-5-methyl-4-phenyl-2-thiophenyl)amino]-2-oxoethyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[2-[(3-carbamoyl-5-methyl-4-phenylthiophen-2-yl)amino]-2-oxoethyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[2-[(3-carbamoyl-5-methyl-4-phenyl-2-thienyl)amino]-2-keto-ethyl]cyclohexyl]acetic acid Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CC2(CCCCC2)CC(=O)O)C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CC2(CCCCC2)CC(=O)O)C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S/c1-14-18(15-8-4-2-5-9-15)19(20(23)28)21(29-14)24-16(25)12-22(13-17(26)27)10-6-3-7-11-22/h2,4-5,8-9H,3,6-7,10-13H2,1H3,(H2,23,28)(H,24,25)(H,26,27)