5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-pyridin-3-yl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-pyridin-3-yl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(3-pyridyl)oxazole-4-carbonitrile CAS Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(3-pyridinyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-pyridin-3-yl-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-piperonylpiperazino)-2-(3-pyridyl)oxazole-4-carbonitrile Formula: C21H19N5O3 MolecularWeight: 389.40726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=C(N=C(O4)C5=CN=CC=C5)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=C(N=C(O4)C5=CN=CC=C5)C#N

InChI

InChI=1S/C21H19N5O3/c22-11-17-21(29-20(24-17)16-2-1-5-23-12-16)26-8-6-25(7-9-26)13-15-3-4-18-19(10-15)28-14-27-18/h1-5,10,12H,6-9,13-14H2