(2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-[4-(phenylcarbonyl)piperazin-1-yl]butanenitrile

Systemtic Name: (2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-[4-(phenylcarbonyl)piperazin-1-yl]butanenitrile Openeye Name: (2Z)-4-(4-benzoylpiperazin-1-yl)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxo-butanenitrile CAS Name: (2Z)-4-(4-benzoyl-1-piperazinyl)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: (2Z)-4-(4-benzoylpiperazin-1-yl)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxobutanenitrile Traditional Name: (2Z)-4-(4-benzoylpiperazino)-3-keto-2-(3-methyl-1,3-benzothiazol-2-ylidene)butyronitrile Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=C(C#N)C(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=C(/C#N)\C(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-25-19-9-5-6-10-21(19)30-23(25)18(15-24)20(28)16-26-11-13-27(14-12-26)22(29)17-7-3-2-4-8-17/h2-10H,11-14,16H2,1H3/b23-18-