methyl 2-[2-[(1-ethylpyrazol-4-yl)methyl-methyl-amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[(1-ethylpyrazol-4-yl)methyl-methyl-amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[(1-ethylpyrazol-4-yl)methyl-methyl-amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(1-ethyl-4-pyrazolyl)methyl-methylamino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(1-ethylpyrazol-4-yl)methyl-methylamino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[(1-ethylpyrazol-4-yl)methyl-methyl-amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CN(C)CC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCN1C=C(C=N1)CN(C)CC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H24N4O3S/c1-4-25-12-15(10-22-25)11-24(2)13-18(26)23-20-19(21(27)28-3)17(14-29-20)16-8-6-5-7-9-16/h5-10,12,14H,4,11,13H2,1-3H3,(H,23,26)