ethyl 2-[2-[bis(phenylmethyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[bis(phenylmethyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(dibenzylamino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[bis(phenylmethyl)amino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(dibenzylamino)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(dibenzylamino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O3S/c1-4-30-25(29)23-18(2)19(3)31-24(23)26-22(28)17-27(15-20-11-7-5-8-12-20)16-21-13-9-6-10-14-21/h5-14H,4,15-17H2,1-3H3,(H,26,28)