3-(1,4-diazepan-1-yl)-5-(4-pyrazol-1-ylphenyl)pyrazin-2-amine

Systemtic Name: 3-(1,4-diazepan-1-yl)-5-(4-pyrazol-1-ylphenyl)pyrazin-2-amine Openeye Name: 3-(1,4-diazepan-1-yl)-5-(4-pyrazol-1-ylphenyl)pyrazin-2-amine CAS Name: 3-(1,4-diazepan-1-yl)-5-[4-(1-pyrazolyl)phenyl]-2-pyrazinamine IUPAC Name: 3-(1,4-diazepan-1-yl)-5-(4-pyrazol-1-ylphenyl)pyrazin-2-amine Traditional Name: [3-(1,4-diazepan-1-yl)-5-(4-pyrazol-1-ylphenyl)pyrazin-2-yl]amine Formula: C18H21N7 MolecularWeight: 335.40624

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=NC(=CN=C2N)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CNCCN(C1)C2=NC(=CN=C2N)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C18H21N7/c19-17-18(24-10-1-7-20-9-12-24)23-16(13-21-17)14-3-5-15(6-4-14)25-11-2-8-22-25/h2-6,8,11,13,20H,1,7,9-10,12H2,(H2,19,21)