methyl 2-[1-(3-bicyclo[2.2.1]heptanyl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[1-(3-bicyclo[2.2.1]heptanyl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-(1-norbornan-2-ylethylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 2-[[[1-(3-bicyclo[2.2.1]heptanyl)ethylamino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(3-bicyclo[2.2.1]heptanyl)ethylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 5-methyl-2-[1-(2-norbornyl)ethylthiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C17H24N2O2S2 MolecularWeight: 352.51466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC(C)C2CC3CCC2C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC(C)C2CC3CCC2C3)C(=O)OC

InChI

InChI=1S/C17H24N2O2S2/c1-9-6-14(16(20)21-3)15(23-9)19-17(22)18-10(2)13-8-11-4-5-12(13)7-11/h6,10-13H,4-5,7-8H2,1-3H3,(H2,18,19,22)