methyl 2-[2-(4-bromanylpyrazol-1-yl)ethylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(4-bromanylpyrazol-1-yl)ethylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[2-(4-bromopyrazol-1-yl)ethylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[2-(4-bromo-1-pyrazolyl)ethylamino]-sulfanylidenemethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-bromopyrazol-1-yl)ethylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[2-(4-bromopyrazol-1-yl)ethylthiocarbamoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C15H17BrN4O2S2 MolecularWeight: 429.35508

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC2)NC(=S)NCCN3C=C(C=N3)Br

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC2)NC(=S)NCCN3C=C(C=N3)Br

InChI

InChI=1S/C15H17BrN4O2S2/c1-22-14(21)12-10-3-2-4-11(10)24-13(12)19-15(23)17-5-6-20-8-9(16)7-18-20/h7-8H,2-6H2,1H3,(H2,17,19,23)