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

Systemtic Name: ethyl 2-[2-[(1,3-dimethylpyrazol-4-yl)methyl-methyl-amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(1,3-dimethylpyrazol-4-yl)methyl-methyl-amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(1,3-dimethyl-4-pyrazolyl)methyl-methylamino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(1,3-dimethylpyrazol-4-yl)methyl-methylamino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[(1,3-dimethylpyrazol-4-yl)methyl-methyl-amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN(C)CC3=CN(N=C3C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN(C)CC3=CN(N=C3C)C

InChI

InChI=1S/C22H26N4O3S/c1-5-29-22(28)20-18(16-9-7-6-8-10-16)14-30-21(20)23-19(27)13-25(3)11-17-12-26(4)24-15(17)2/h6-10,12,14H,5,11,13H2,1-4H3,(H,23,27)