N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(4-iodo-5-methyl-pyrazol-1-yl)propanamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-3-(4-iodo-5-methyl-1-pyrazolyl)propanamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-3-(4-iodo-5-methylpyrazol-1-yl)propanamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(4-iodo-5-methyl-pyrazol-1-yl)propionamide Formula: C17H17ClIN5O MolecularWeight: 469.70725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=NN(C=C2Cl)CC3=CC=CC=C3)I

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=NN(C=C2Cl)CC3=CC=CC=C3)I

InChI

InChI=1S/C17H17ClIN5O/c1-12-15(19)9-20-24(12)8-7-16(25)21-17-14(18)11-23(22-17)10-13-5-3-2-4-6-13/h2-6,9,11H,7-8,10H2,1H3,(H,21,22,25)