2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]butanamide

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]butanamide Openeye Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]butanamide CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[1-[(4-ethylphenoxy)methyl]-4-pyrazolyl]butanamide IUPAC Name: 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]butanamide Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]butyramide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=O)C(CC)N3C(=C(C(=N3)C)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=O)C(CC)N3C(=C(C(=N3)C)Cl)C

InChI

InChI=1S/C21H26ClN5O2/c1-5-16-7-9-18(10-8-16)29-13-26-12-17(11-23-26)24-21(28)19(6-2)27-15(4)20(22)14(3)25-27/h7-12,19H,5-6,13H2,1-4H3,(H,24,28)