6-[(4-cyclopropyl-1,4-diazepan-1-yl)carbonyl]-3-pyridin-3-yloxy-pyridine-2-carbonitrile

Systemtic Name: 6-[(4-cyclopropyl-1,4-diazepan-1-yl)carbonyl]-3-pyridin-3-yloxy-pyridine-2-carbonitrile Openeye Name: 6-(4-cyclopropyl-1,4-diazepane-1-carbonyl)-3-(3-pyridyloxy)pyridine-2-carbonitrile CAS Name: 6-[(4-cyclopropyl-1,4-diazepan-1-yl)-oxomethyl]-3-(3-pyridinyloxy)-2-pyridinecarbonitrile IUPAC Name: 6-(4-cyclopropyl-1,4-diazepane-1-carbonyl)-3-pyridin-3-yloxypyridine-2-carbonitrile Traditional Name: 6-(4-cyclopropyl-1,4-diazepane-1-carbonyl)-3-(3-pyridyloxy)picolinonitrile Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=NC(=C(C=C2)OC3=CN=CC=C3)C#N)C4CC4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=NC(=C(C=C2)OC3=CN=CC=C3)C#N)C4CC4

InChI

InChI=1S/C20H21N5O2/c21-13-18-19(27-16-3-1-8-22-14-16)7-6-17(23-18)20(26)25-10-2-9-24(11-12-25)15-4-5-15/h1,3,6-8,14-15H,2,4-5,9-12H2