methyl 2-[(2-ethylpyrazol-3-yl)methylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-ethylpyrazol-3-yl)methylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[(2-ethylpyrazol-3-yl)methylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[(2-ethyl-3-pyrazolyl)methylamino]-sulfanylidenemethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-ethylpyrazol-3-yl)methylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(2-ethylpyrazol-3-yl)methylthiocarbamoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C16H20N4O2S2 MolecularWeight: 364.4856

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)CNC(=S)NC2=C(C3=C(S2)CCC3)C(=O)OC

Isomeric SMILES

CCN1C(=CC=N1)CNC(=S)NC2=C(C3=C(S2)CCC3)C(=O)OC

InChI

InChI=1S/C16H20N4O2S2/c1-3-20-10(7-8-18-20)9-17-16(23)19-14-13(15(21)22-2)11-5-4-6-12(11)24-14/h7-8H,3-6,9H2,1-2H3,(H2,17,19,23)