2-chloranyl-6-[[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]amino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]amino]benzenecarbonitrile Openeye Name: 2-chloro-6-[[(2S)-2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]amino]benzonitrile CAS Name: 2-chloro-6-[[(2S)-2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]amino]benzonitrile IUPAC Name: 2-chloro-6-[[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]amino]benzonitrile Traditional Name: 2-chloro-6-[[(2S)-2-pyrrolidino-2-(2-thienyl)ethyl]amino]benzonitrile Formula: C17H18ClN3S MolecularWeight: 331.86292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC2=C(C(=CC=C2)Cl)C#N)C3=CC=CS3

Isomeric SMILES

C1CCN(C1)[C@@H](CNC2=C(C(=CC=C2)Cl)C#N)C3=CC=CS3

InChI

InChI=1S/C17H18ClN3S/c18-14-5-3-6-15(13(14)11-19)20-12-16(17-7-4-10-22-17)21-8-1-2-9-21/h3-7,10,16,20H,1-2,8-9,12H2/t16-/m0/s1