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

Systemtic Name: ethyl 2-[2-[ethyl-(phenylmethyl)amino]ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[benzyl(ethyl)amino]acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[2-[ethyl-(phenylmethyl)amino]-1-oxoethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[benzyl(ethyl)amino]acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[benzyl(ethyl)amino]acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC(=O)NC2=C(C(=C(S2)C(=O)NC)C)C(=O)OCC

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC(=O)NC2=C(C(=C(S2)C(=O)NC)C)C(=O)OCC

InChI

InChI=1S/C21H27N3O4S/c1-5-24(12-15-10-8-7-9-11-15)13-16(25)23-20-17(21(27)28-6-2)14(3)18(29-20)19(26)22-4/h7-11H,5-6,12-13H2,1-4H3,(H,22,26)(H,23,25)