2-(4-quinoxalin-6-ylcarbonyl-1,4-diazepan-1-yl)pyridine-3-carbonitrile

Systemtic Name: 2-(4-quinoxalin-6-ylcarbonyl-1,4-diazepan-1-yl)pyridine-3-carbonitrile Openeye Name: 2-[4-(quinoxaline-6-carbonyl)-1,4-diazepan-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[oxo(6-quinoxalinyl)methyl]-1,4-diazepan-1-yl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(quinoxaline-6-carbonyl)-1,4-diazepan-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(quinoxaline-6-carbonyl)-1,4-diazepan-1-yl]nicotinonitrile Formula: C20H18N6O MolecularWeight: 358.39652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC3=NC=CN=C3C=C2)C4=C(C=CC=N4)C#N

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC3=NC=CN=C3C=C2)C4=C(C=CC=N4)C#N

InChI

InChI=1S/C20H18N6O/c21-14-16-3-1-6-24-19(16)25-9-2-10-26(12-11-25)20(27)15-4-5-17-18(13-15)23-8-7-22-17/h1,3-8,13H,2,9-12H2