methyl 3-[2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[tetrahydrofuran-2-ylmethyl(2-thienylmethyl)amino]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-[2-oxolanylmethyl(thiophen-2-ylmethyl)amino]ethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[tetrahydrofurfuryl(2-thenyl)amino]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CN(CC2CCCO2)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CN(CC2CCCO2)CC3=CC=CS3

InChI

InChI=1S/C18H22N2O4S2/c1-23-18(22)17-15(6-9-26-17)19-16(21)12-20(10-13-4-2-7-24-13)11-14-5-3-8-25-14/h3,5-6,8-9,13H,2,4,7,10-12H2,1H3,(H,19,21)