AC1M3EO8

diethyl 3-methyl-5-[(4-methylsulfonylpiperazine-1-carbothioyl)amino]thiophene-2,4-dicarboxylate

Also Known As: diethyl 3-methyl-5-({[4-(methylsulfonyl)piperazin-1-yl]carbonothioyl}amino)thiophene-2,4-dicarboxylate|diethyl 3-methyl-5-(4-(methylsulfonyl)piperazine-1-carbothioamido)thiophene-2,4-dicarboxylate|diethyl 3-methyl-5-[(4-methylsulfonylpiperazine-1-carbothioyl)amino]thiophene-2,4-dicarboxylate|ethyl 5-(ethoxycarbonyl)-4-methyl-2-({[4-(methylsulfonyl)piperazinyl]thioxomet hyl}amino)thiophene-3-carboxylate

Molecular Formula	C17H25N3O6S3
Molecular Weight	463.09055 g/mol
LogP	1.68392
Topological Polar Surface Area	105.25 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	463.09055
Monoisotopic Mass	463.09055
Heavy Atoms	29
Complexity	888.46985

Chemical Identifiers

CAS Number	708237-45-0
SMILES	CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCN(CC2)S(=O)(=O)C