ethyl 2-[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H29N3O4S+2 MolecularWeight: 371.49486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C[NH+]2CC[NH+](CC2)CCO

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C[NH+]2CC[NH+](CC2)CCO

InChI

InChI=1S/C17H27N3O4S/c1-4-24-17(23)15-12(2)13(3)25-16(15)18-14(22)11-20-7-5-19(6-8-20)9-10-21/h21H,4-11H2,1-3H3,(H,18,22)/p+2