ethyl 3-methyl-5-[2-[[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-amino]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[2-[[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-amino]ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-[[2-(2-methylanilino)-2-oxo-ethyl]-propyl-amino]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[2-[[2-keto-2-(o-toluidino)ethyl]-propyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)CC(=O)NC2=CC(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)CC(=O)NC2=CC(=C(S2)C(=O)OCC)C

InChI

InChI=1S/C22H29N3O4S/c1-5-11-25(13-18(26)23-17-10-8-7-9-15(17)3)14-19(27)24-20-12-16(4)21(30-20)22(28)29-6-2/h7-10,12H,5-6,11,13-14H2,1-4H3,(H,23,26)(H,24,27)