[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 5-methylthiophene-2-carboxylate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 5-methylthiophene-2-carboxylate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] 5-methylthiophene-2-carboxylate CAS Name: 5-methyl-2-thiophenecarboxylic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 5-methylthiophene-2-carboxylate Traditional Name: 5-methylthiophene-2-carboxylic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N

Isomeric SMILES

CC1=CC=C(S1)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N

InChI

InChI=1S/C16H20N2O3S/c1-11-6-7-13(22-11)15(20)21-12(2)14(19)18-16(10-17)8-4-3-5-9-16/h6-7,12H,3-5,8-9H2,1-2H3,(H,18,19)