methyl 1-[2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-[2-(4-ethoxyphenyl)thiazol-4-yl]acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-[2-(4-ethoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(2-p-phenetylthiazol-4-yl)acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)NC3(CCCCC3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)NC3(CCCCC3)C(=O)OC

InChI

InChI=1S/C21H26N2O4S/c1-3-27-17-9-7-15(8-10-17)19-22-16(14-28-19)13-18(24)23-21(20(25)26-2)11-5-4-6-12-21/h7-10,14H,3-6,11-13H2,1-2H3,(H,23,24)