ethyl 5-ethanoyl-4-methyl-2-[2-[methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[2-[methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[2-[[2-(isopropylamino)-2-oxo-ethyl]-methyl-amino]acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[2-[[2-(isopropylamino)-2-keto-ethyl]-methyl-amino]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CN(C)CC(=O)NC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CN(C)CC(=O)NC(C)C

InChI

InChI=1S/C18H27N3O5S/c1-7-26-18(25)15-11(4)16(12(5)22)27-17(15)20-14(24)9-21(6)8-13(23)19-10(2)3/h10H,7-9H2,1-6H3,(H,19,23)(H,20,24)