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

Systemtic Name: ethyl 5-aminocarbonyl-2-[2-[bis(phenylmethyl)amino]ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[[2-(dibenzylamino)acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[bis(phenylmethyl)amino]-1-oxoethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-[[2-(dibenzylamino)acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[2-(dibenzylamino)acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O4S/c1-3-32-25(31)21-17(2)22(23(26)30)33-24(21)27-20(29)16-28(14-18-10-6-4-7-11-18)15-19-12-8-5-9-13-19/h4-13H,3,14-16H2,1-2H3,(H2,26,30)(H,27,29)