methyl 4-ethyl-2-[(1-ethyl-3-methyl-pyrazol-4-yl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-2-[(1-ethyl-3-methyl-pyrazol-4-yl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-2-[(1-ethyl-3-methyl-pyrazol-4-yl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-2-[[[(1-ethyl-3-methyl-4-pyrazolyl)methylamino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-2-[(1-ethyl-3-methylpyrazol-4-yl)methylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-2-[(1-ethyl-3-methyl-pyrazol-4-yl)methylthiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H24N4O2S2 MolecularWeight: 380.52806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=CN(N=C2C)CC)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=CN(N=C2C)CC)C

InChI

InChI=1S/C17H24N4O2S2/c1-6-13-11(4)25-15(14(13)16(22)23-5)19-17(24)18-8-12-9-21(7-2)20-10(12)3/h9H,6-8H2,1-5H3,(H2,18,19,24)