4-[[4-[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[5-(1,3-benzothiazol-2-yl)-2-furoyl]piperazino]methyl]benzonitrile Formula: C24H20N4O2S MolecularWeight: 428.5062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H20N4O2S/c25-15-17-5-7-18(8-6-17)16-27-11-13-28(14-12-27)24(29)21-10-9-20(30-21)23-26-19-3-1-2-4-22(19)31-23/h1-10H,11-14,16H2