4-[butyl(methyl)amino]-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile

Systemtic Name: 4-[butyl(methyl)amino]-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Openeye Name: 4-[butyl(methyl)amino]-3-oxo-2-(4-phenylthiazol-2-yl)butanenitrile CAS Name: 4-[butyl(methyl)amino]-3-oxo-2-(4-phenyl-2-thiazolyl)butanenitrile IUPAC Name: 4-[butyl(methyl)amino]-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)butanenitrile Traditional Name: 4-[butyl(methyl)amino]-3-keto-2-(4-phenylthiazol-2-yl)butyronitrile Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CC(=O)C(C#N)C1=NC(=CS1)C2=CC=CC=C2

Isomeric SMILES

CCCCN(C)CC(=O)C(C#N)C1=NC(=CS1)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3OS/c1-3-4-10-21(2)12-17(22)15(11-19)18-20-16(13-23-18)14-8-6-5-7-9-14/h5-9,13,15H,3-4,10,12H2,1-2H3