3-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]-2-(4-phenyl-3H-1,3-thiazol-2-ylidene)butanenitrile

Systemtic Name: 3-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]-2-(4-phenyl-3H-1,3-thiazol-2-ylidene)butanenitrile Openeye Name: 4-(4-benzylpiperazin-1-yl)-3-oxo-2-(4-phenyl-3H-thiazol-2-ylidene)butanenitrile CAS Name: 3-oxo-4-[4-(phenylmethyl)-1-piperazinyl]-2-(4-phenyl-3H-thiazol-2-ylidene)butanenitrile IUPAC Name: 4-(4-benzylpiperazin-1-yl)-3-oxo-2-(4-phenyl-3H-1,3-thiazol-2-ylidene)butanenitrile Traditional Name: 4-(4-benzylpiperazino)-3-keto-2-(4-phenyl-4-thiazolin-2-ylidene)butyronitrile Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(=O)C(=C3NC(=CS3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(=O)C(=C3NC(=CS3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H24N4OS/c25-15-21(24-26-22(18-30-24)20-9-5-2-6-10-20)23(29)17-28-13-11-27(12-14-28)16-19-7-3-1-4-8-19/h1-10,18,26H,11-14,16-17H2