propan-2-yl 4-cyano-5-(cyclohexylcarbamoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-5-(cyclohexylcarbamoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-5-(cyclohexylcarbamoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[(cyclohexylamino)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-5-(cyclohexylcarbamoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-(cyclohexylcarbamoylamino)-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)NC2CCCCC2)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)NC2CCCCC2)C(=O)OC(C)C

InChI

InChI=1S/C17H23N3O3S/c1-10(2)23-16(21)14-11(3)13(9-18)15(24-14)20-17(22)19-12-7-5-4-6-8-12/h10,12H,4-8H2,1-3H3,(H2,19,20,22)