diethyl 5-[2-[bis(phenylmethyl)amino]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-[bis(phenylmethyl)amino]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(dibenzylamino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[bis(phenylmethyl)amino]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(dibenzylamino)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(dibenzylamino)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O5S/c1-4-33-26(31)23-19(3)24(27(32)34-5-2)35-25(23)28-22(30)18-29(16-20-12-8-6-9-13-20)17-21-14-10-7-11-15-21/h6-15H,4-5,16-18H2,1-3H3,(H,28,30)