ethyl 3-azanyl-5-methyl-4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-5-methyl-4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)thiophene-2-carboxylate Openeye Name: ethyl 3-amino-5-methyl-4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)thiophene-2-carboxylate CAS Name: 3-amino-5-methyl-4-[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-methyl-4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)thiophene-2-carboxylate Traditional Name: 3-amino-5-methyl-4-(3-morpholin-4-ium-4-ylpropylcarbamoyl)thiophene-2-carboxylic acid ethyl ester Formula: C16H26N3O4S+ MolecularWeight: 356.46034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)C)C(=O)NCCC[NH+]2CCOCC2)N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)C)C(=O)NCCC[NH+]2CCOCC2)N

InChI

InChI=1S/C16H25N3O4S/c1-3-23-16(21)14-13(17)12(11(2)24-14)15(20)18-5-4-6-19-7-9-22-10-8-19/h3-10,17H2,1-2H3,(H,18,20)/p+1