1-[2-[[1-(4-phenyl-1,3-thiazol-2-yl)piperidin-4-yl]amino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: 1-[2-[[1-(4-phenyl-1,3-thiazol-2-yl)piperidin-4-yl]amino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: 1-[2-[[1-(4-phenylthiazol-2-yl)-4-piperidyl]amino]acetyl]pyrrolidine-2-carbonitrile CAS Name: 1-[1-oxo-2-[[1-(4-phenyl-2-thiazolyl)-4-piperidinyl]amino]ethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[2-[[1-(4-phenyl-1,3-thiazol-2-yl)piperidin-4-yl]amino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[2-[[1-(4-phenylthiazol-2-yl)-4-piperidyl]amino]acetyl]pyrrolidine-2-carbonitrile Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNC2CCN(CC2)C3=NC(=CS3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)CNC2CCN(CC2)C3=NC(=CS3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H25N5OS/c22-13-18-7-4-10-26(18)20(27)14-23-17-8-11-25(12-9-17)21-24-19(15-28-21)16-5-2-1-3-6-16/h1-3,5-6,15,17-18,23H,4,7-12,14H2