4-(4-chloranyl-2-methyl-phenoxy)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(6-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=CN=C(C=C2)N3C=CC=N3

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O2/c1-15-12-17(21)6-7-18(15)27-11-2-4-20(26)23-14-16-5-8-19(22-13-16)25-10-3-9-24-25/h3,5-10,12-13H,2,4,11,14H2,1H3,(H,23,26)