methyl 5-(diethylcarbamoyl)-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[[(1-ethyl-3,5-dimethyl-4-pyrazolyl)amino]-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[(1-ethyl-3,5-dimethylpyrazol-4-yl)carbamothioylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)thiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H29N5O3S2 MolecularWeight: 451.60596

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)NC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)NC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC)C

InChI

InChI=1S/C20H29N5O3S2/c1-8-24(9-2)18(26)16-11(4)14(19(27)28-7)17(30-16)22-20(29)21-15-12(5)23-25(10-3)13(15)6/h8-10H2,1-7H3,(H2,21,22,29)