4-(4-chloranyl-2-methyl-phenoxy)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]butyramide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCC2=C(N=CC=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCC2=C(N=CC=C2)N3C=CC=N3

InChI

InChI=1S/C20H21ClN4O2/c1-15-13-17(21)7-8-18(15)27-12-3-6-19(26)23-14-16-5-2-9-22-20(16)25-11-4-10-24-25/h2,4-5,7-11,13H,3,6,12,14H2,1H3,(H,23,26)