5-chloranyl-6-(2-methylpropyl)-3-phenyl-1-(phenylmethyl)pyrazin-2-one

Systemtic Name: 5-chloranyl-6-(2-methylpropyl)-3-phenyl-1-(phenylmethyl)pyrazin-2-one Openeye Name: 1-benzyl-5-chloro-6-isobutyl-3-phenyl-pyrazin-2-one CAS Name: 5-chloro-6-(2-methylpropyl)-3-phenyl-1-(phenylmethyl)-2-pyrazinone IUPAC Name: 1-benzyl-5-chloro-6-(2-methylpropyl)-3-phenylpyrazin-2-one Traditional Name: 1-benzyl-5-chloro-6-isobutyl-3-phenyl-pyrazin-2-one Formula: C21H21ClN2O MolecularWeight: 352.85724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(C(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)CC1=C(N=C(C(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O/c1-15(2)13-18-20(22)23-19(17-11-7-4-8-12-17)21(25)24(18)14-16-9-5-3-6-10-16/h3-12,15H,13-14H2,1-2H3