methyl 5-(diethylcarbamoyl)-2-[[(4-ethyl-5-methyl-thiophen-3-yl)carbonylamino]carbamothioylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[[(4-ethyl-5-methyl-thiophen-3-yl)carbonylamino]carbamothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[[(4-ethyl-5-methyl-thiophene-3-carbonyl)amino]carbamothioylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[[[(4-ethyl-5-methyl-3-thiophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[[(4-ethyl-5-methylthiophene-3-carbonyl)amino]carbamothioylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[[(4-ethyl-5-methyl-thiophene-3-carbonyl)amino]thiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H28N4O4S3 MolecularWeight: 496.66642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C(=O)NNC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC)C

Isomeric SMILES

CCC1=C(SC=C1C(=O)NNC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC)C

InChI

InChI=1S/C21H28N4O4S3/c1-7-13-12(5)31-10-14(13)17(26)23-24-21(30)22-18-15(20(28)29-6)11(4)16(32-18)19(27)25(8-2)9-3/h10H,7-9H2,1-6H3,(H,23,26)(H2,22,24,30)