ethyl 1-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylamino]-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylamino]-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NCC2=C(N(N=C2C)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NCC2=C(N(N=C2C)C3=CC=CC=C3)C)C

InChI

InChI=1S/C23H28N4O3/c1-6-30-23(29)20-12-15(2)26(17(20)4)14-22(28)24-13-21-16(3)25-27(18(21)5)19-10-8-7-9-11-19/h7-12H,6,13-14H2,1-5H3,(H,24,28)