methyl 5-(diethylcarbamoyl)-2-[(4-ethylpiperazin-1-yl)carbothioylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[(4-ethylpiperazin-1-yl)carbothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[(4-ethylpiperazine-1-carbothioyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[(4-ethyl-1-piperazinyl)-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[(4-ethylpiperazine-1-carbothioyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[(4-ethylpiperazine-1-carbothioyl)amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C19H30N4O3S2 MolecularWeight: 426.5965

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC

Isomeric SMILES

CCN1CCN(CC1)C(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC

InChI

InChI=1S/C19H30N4O3S2/c1-6-21-9-11-23(12-10-21)19(27)20-16-14(18(25)26-5)13(4)15(28-16)17(24)22(7-2)8-3/h6-12H2,1-5H3,(H,20,27)