methyl 5-ethyl-2-(2-piperidin-1-ylethylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-(2-piperidin-1-ylethylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[2-(1-piperidyl)ethylcarbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[2-(1-piperidinyl)ethylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-(2-piperidin-1-ylethylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-ethyl-2-(2-piperidinoethylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C16H25N3O2S2 MolecularWeight: 355.5186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NCCN2CCCCC2)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NCCN2CCCCC2)C(=O)OC

InChI

InChI=1S/C16H25N3O2S2/c1-3-12-11-13(15(20)21-2)14(23-12)18-16(22)17-7-10-19-8-5-4-6-9-19/h11H,3-10H2,1-2H3,(H2,17,18,22)