ethyl 4-ethyl-5-methyl-2-[2-(4-methyl-1,4-diazepan-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(4-methyl-1,4-diazepan-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[2-(4-methyl-1,4-diazepan-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[2-(4-methyl-1,4-diazepan-1-yl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-(4-methyl-1,4-diazepan-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[2-(4-methyl-1,4-diazepan-1-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H29N3O3S MolecularWeight: 367.50616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2CCCN(CC2)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2CCCN(CC2)C)C

InChI

InChI=1S/C18H29N3O3S/c1-5-14-13(3)25-17(16(14)18(23)24-6-2)19-15(22)12-21-9-7-8-20(4)10-11-21/h5-12H2,1-4H3,(H,19,22)