2-azanyl-4,4-bis(propylsulfanyl)-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

Systemtic Name: 2-azanyl-4,4-bis(propylsulfanyl)-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-4,4-bis(propylsulfanyl)-6-(4-pyridyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-4,4-bis(propylthio)-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-4,4-bis(propylsulfanyl)-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-4,4-bis(propylthio)-6-(4-pyridyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Formula: C18H21N5S2 MolecularWeight: 371.52284

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1(C2(C(C2(C(=N1)N)C#N)C3=CC=NC=C3)C#N)SCCC

Isomeric SMILES

CCCSC1(C2(C(C2(C(=N1)N)C#N)C3=CC=NC=C3)C#N)SCCC

InChI

InChI=1S/C18H21N5S2/c1-3-9-24-18(25-10-4-2)17(12-20)14(13-5-7-22-8-6-13)16(17,11-19)15(21)23-18/h5-8,14H,3-4,9-10H2,1-2H3,(H2,21,23)