5-chloranyl-6-(3,4-dimethoxyphenyl)-1-phenyl-3-[(phenylmethyl)amino]pyrazin-2-one

Systemtic Name: 5-chloranyl-6-(3,4-dimethoxyphenyl)-1-phenyl-3-[(phenylmethyl)amino]pyrazin-2-one Openeye Name: 3-(benzylamino)-5-chloro-6-(3,4-dimethoxyphenyl)-1-phenyl-pyrazin-2-one CAS Name: 5-chloro-6-(3,4-dimethoxyphenyl)-1-phenyl-3-[(phenylmethyl)amino]-2-pyrazinone IUPAC Name: 3-(benzylamino)-5-chloro-6-(3,4-dimethoxyphenyl)-1-phenylpyrazin-2-one Traditional Name: 3-(benzylamino)-5-chloro-6-(3,4-dimethoxyphenyl)-1-phenyl-pyrazin-2-one Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N=C(C(=O)N2C3=CC=CC=C3)NCC4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N=C(C(=O)N2C3=CC=CC=C3)NCC4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C25H22ClN3O3/c1-31-20-14-13-18(15-21(20)32-2)22-23(26)28-24(27-16-17-9-5-3-6-10-17)25(30)29(22)19-11-7-4-8-12-19/h3-15H,16H2,1-2H3,(H,27,28)