6-chloranyl-3-(3,5-dimethylpyrazol-1-yl)-N-(4-ethoxyphenyl)quinoxalin-2-amine

Systemtic Name: 6-chloranyl-3-(3,5-dimethylpyrazol-1-yl)-N-(4-ethoxyphenyl)quinoxalin-2-amine Openeye Name: 6-chloro-3-(3,5-dimethylpyrazol-1-yl)-N-(4-ethoxyphenyl)quinoxalin-2-amine CAS Name: 6-chloro-3-(3,5-dimethyl-1-pyrazolyl)-N-(4-ethoxyphenyl)-2-quinoxalinamine IUPAC Name: 6-chloro-3-(3,5-dimethylpyrazol-1-yl)-N-(4-ethoxyphenyl)quinoxalin-2-amine Traditional Name: [6-chloro-3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]-p-phenetyl-amine Formula: C21H20ClN5O MolecularWeight: 393.8694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)Cl)N=C2N4C(=CC(=N4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)Cl)N=C2N4C(=CC(=N4)C)C

InChI

InChI=1S/C21H20ClN5O/c1-4-28-17-8-6-16(7-9-17)23-20-21(27-14(3)11-13(2)26-27)25-19-12-15(22)5-10-18(19)24-20/h5-12H,4H2,1-3H3,(H,23,24)