2-(morpholin-4-ylamino)-3-(phenylmethylsulfanyl)propanenitrile

Systemtic Name: 2-(morpholin-4-ylamino)-3-(phenylmethylsulfanyl)propanenitrile Openeye Name: 3-benzylsulfanyl-2-(morpholinoamino)propanenitrile CAS Name: 2-(4-morpholinylamino)-3-(phenylmethylthio)propanenitrile IUPAC Name: 3-benzylsulfanyl-2-(morpholin-4-ylamino)propanenitrile Traditional Name: 3-(benzylthio)-2-(morpholinoamino)propionitrile Formula: C14H19N3OS MolecularWeight: 277.38516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC(CSCC2=CC=CC=C2)C#N

Isomeric SMILES

C1COCCN1NC(CSCC2=CC=CC=C2)C#N

InChI

InChI=1S/C14H19N3OS/c15-10-14(16-17-6-8-18-9-7-17)12-19-11-13-4-2-1-3-5-13/h1-5,14,16H,6-9,11-12H2