1-(3-chlorophenyl)-3-pyrazin-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(3-chlorophenyl)-3-pyrazin-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3-chlorophenyl)-3-pyrazin-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3-chlorophenyl)-3-(2-pyrazinyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3-chlorophenyl)-3-pyrazin-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3-chlorophenyl)-3-pyrazin-2-yl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C17H16ClN5 MolecularWeight: 325.79544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NN2C3=CC(=CC=C3)Cl)C4=NC=CN=C4)C1

Isomeric SMILES

C1CCN=C2C(=C(NN2C3=CC(=CC=C3)Cl)C4=NC=CN=C4)C1

InChI

InChI=1S/C17H16ClN5/c18-12-4-3-5-13(10-12)23-17-14(6-1-2-7-21-17)16(22-23)15-11-19-8-9-20-15/h3-5,8-11,22H,1-2,6-7H2