3-chloranyl-5-[[4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methylamino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-chloranyl-5-[[4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methylamino]-1,2-thiazole-4-carbonitrile Openeye Name: 3-chloro-5-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methylamino]isothiazole-4-carbonitrile CAS Name: 3-chloro-5-[[4-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methylamino]-4-isothiazolecarbonitrile IUPAC Name: 3-chloro-5-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methylamino]-1,2-thiazole-4-carbonitrile Traditional Name: 3-chloro-5-[[4-[(2-ketopyrrolidino)methyl]benzyl]amino]isothiazole-4-carbonitrile Formula: C16H15ClN4OS MolecularWeight: 346.8345

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=C(C=C2)CNC3=C(C(=NS3)Cl)C#N

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=C(C=C2)CNC3=C(C(=NS3)Cl)C#N

InChI

InChI=1S/C16H15ClN4OS/c17-15-13(8-18)16(23-20-15)19-9-11-3-5-12(6-4-11)10-21-7-1-2-14(21)22/h3-6,19H,1-2,7,9-10H2