ethyl 5-[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)CC(=O)NC3=CC(=C(S3)C(=O)OCC)C

Isomeric SMILES

CCN(CC1COC2=CC=CC=C2O1)CC(=O)NC3=CC(=C(S3)C(=O)OCC)C

InChI

InChI=1S/C21H26N2O5S/c1-4-23(11-15-13-27-16-8-6-7-9-17(16)28-15)12-18(24)22-19-10-14(3)20(29-19)21(25)26-5-2/h6-10,15H,4-5,11-13H2,1-3H3,(H,22,24)