methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]carbothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]carbothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioyl]amino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[4-(oxolane-2-carbonyl)piperazine-1-carbothioyl]amino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-[[4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H28N4O5S2 MolecularWeight: 468.59012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C(=O)C3CCCO3)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C(=O)C3CCCO3)C(=O)N(C)C

InChI

InChI=1S/C20H28N4O5S2/c1-12-14(19(27)28-4)16(31-15(12)18(26)22(2)3)21-20(30)24-9-7-23(8-10-24)17(25)13-6-5-11-29-13/h13H,5-11H2,1-4H3,(H,21,30)