2-(2-oxidanylidene-1,3-thiazolidin-4-yl)-2-[(phenylmethyl)amino]ethanenitrile

Systemtic Name: 2-(2-oxidanylidene-1,3-thiazolidin-4-yl)-2-[(phenylmethyl)amino]ethanenitrile Openeye Name: 2-(benzylamino)-2-(2-oxothiazolidin-4-yl)acetonitrile CAS Name: 2-(2-oxo-4-thiazolidinyl)-2-[(phenylmethyl)amino]acetonitrile IUPAC Name: 2-(benzylamino)-2-(2-oxo-1,3-thiazolidin-4-yl)acetonitrile Traditional Name: 2-(benzylamino)-2-(2-ketothiazolidin-4-yl)acetonitrile Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)S1)C(C#N)NCC2=CC=CC=C2

Isomeric SMILES

C1C(NC(=O)S1)C(C#N)NCC2=CC=CC=C2

InChI

InChI=1S/C12H13N3OS/c13-6-10(11-8-17-12(16)15-11)14-7-9-4-2-1-3-5-9/h1-5,10-11,14H,7-8H2,(H,15,16)