4-[[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazino]methyl]benzonitrile Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H24N4OS/c24-16-18-8-10-19(11-9-18)17-26-12-14-27(15-13-26)23(28)7-3-6-22-25-20-4-1-2-5-21(20)29-22/h1-2,4-5,8-11H,3,6-7,12-15,17H2