methyl 2-(cycloheptylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(cycloheptylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(cycloheptylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(cycloheptylamino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(cycloheptylcarbamothioylamino)-5-methylthiophene-3-carboxylate Traditional Name: 2-(cycloheptylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2CCCCCC2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2CCCCCC2)C(=O)OC

InChI

InChI=1S/C15H22N2O2S2/c1-10-9-12(14(18)19-2)13(21-10)17-15(20)16-11-7-5-3-4-6-8-11/h9,11H,3-8H2,1-2H3,(H2,16,17,20)