ethyl 2-[2-[bis(2-methoxyethyl)amino]ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[bis(2-methoxyethyl)amino]ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[bis(2-methoxyethyl)amino]acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[bis(2-methoxyethyl)amino]-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[bis(2-methoxyethyl)amino]acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[bis(2-methoxyethyl)amino]acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN(CCOC)CCOC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN(CCOC)CCOC

InChI

InChI=1S/C21H28N2O5S/c1-4-28-21(25)17-14-18(16-8-6-5-7-9-16)29-20(17)22-19(24)15-23(10-12-26-2)11-13-27-3/h5-9,14H,4,10-13,15H2,1-3H3,(H,22,24)