methyl 1-[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]ethanoylamino]-4-methyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]ethanoylamino]-4-methyl-cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-[2-(4-chlorophenyl)-5-methyl-thiazol-4-yl]acetyl]amino]-4-methyl-cyclohexanecarboxylate CAS Name: 1-[[2-[2-(4-chlorophenyl)-5-methyl-4-thiazolyl]-1-oxoethyl]amino]-4-methyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]acetyl]amino]-4-methylcyclohexane-1-carboxylate Traditional Name: 1-[[2-[2-(4-chlorophenyl)-5-methyl-thiazol-4-yl]acetyl]amino]-4-methyl-cyclohexanecarboxylic acid methyl ester Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)OC)NC(=O)CC2=C(SC(=N2)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1CCC(CC1)(C(=O)OC)NC(=O)CC2=C(SC(=N2)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H25ClN2O3S/c1-13-8-10-21(11-9-13,20(26)27-3)24-18(25)12-17-14(2)28-19(23-17)15-4-6-16(22)7-5-15/h4-7,13H,8-12H2,1-3H3,(H,24,25)