4-[4-[2-(cycloheptylamino)-2-oxidanylidene-ethoxy]-5-methyl-1,3-thiazol-2-yl]benzoic acid

Systemtic Name: 4-[4-[2-(cycloheptylamino)-2-oxidanylidene-ethoxy]-5-methyl-1,3-thiazol-2-yl]benzoic acid Openeye Name: 4-[4-[2-(cycloheptylamino)-2-oxo-ethoxy]-5-methyl-thiazol-2-yl]benzoic acid CAS Name: 4-[4-[2-(cycloheptylamino)-2-oxoethoxy]-5-methyl-2-thiazolyl]benzoic acid IUPAC Name: 4-[4-[2-(cycloheptylamino)-2-oxoethoxy]-5-methyl-1,3-thiazol-2-yl]benzoic acid Traditional Name: 4-[4-[2-(cycloheptylamino)-2-keto-ethoxy]-5-methyl-thiazol-2-yl]benzoic acid Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=C(C=C2)C(=O)O)OCC(=O)NC3CCCCCC3

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=C(C=C2)C(=O)O)OCC(=O)NC3CCCCCC3

InChI

InChI=1S/C20H24N2O4S/c1-13-18(26-12-17(23)21-16-6-4-2-3-5-7-16)22-19(27-13)14-8-10-15(11-9-14)20(24)25/h8-11,16H,2-7,12H2,1H3,(H,21,23)(H,24,25)