N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-iodo-3-methyl-pyrazol-1-yl)propanamide CAS Name: N-[1-[(3-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-(4-iodo-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(4-iodo-3-methylpyrazol-1-yl)propanamide Traditional Name: N-[1-(3-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-(4-iodo-3-methyl-pyrazol-1-yl)propionamide Formula: C19H21ClIN5O MolecularWeight: 497.76041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)Cl)C)NC(=O)CCN3C=C(C(=N3)C)I

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)Cl)C)NC(=O)CCN3C=C(C(=N3)C)I

InChI

InChI=1S/C19H21ClIN5O/c1-12-17(21)11-25(23-12)8-7-18(27)22-19-13(2)24-26(14(19)3)10-15-5-4-6-16(20)9-15/h4-6,9,11H,7-8,10H2,1-3H3,(H,22,27)