5-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]piperazin-1-yl]-2-(2-furyl)oxazole-4-carbonitrile CAS Name: 5-[4-[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]-1-piperazinyl]-2-(2-furanyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[2-(1H-benzimidazol-2-ylthio)acetyl]piperazino]-2-(2-furyl)oxazole-4-carbonitrile Formula: C21H18N6O3S MolecularWeight: 434.47102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(N=C(O2)C3=CC=CO3)C#N)C(=O)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CN(CCN1C2=C(N=C(O2)C3=CC=CO3)C#N)C(=O)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H18N6O3S/c22-12-16-20(30-19(23-16)17-6-3-11-29-17)27-9-7-26(8-10-27)18(28)13-31-21-24-14-4-1-2-5-15(14)25-21/h1-6,11H,7-10,13H2,(H,24,25)