6-(2-methylpropyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-(2-methylpropyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 6-isobutyl-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]pyridine-3-carbonitrile CAS Name: 6-(2-methylpropyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-pyridinecarbonitrile IUPAC Name: 6-(2-methylpropyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 6-isobutyl-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]nicotinonitrile Formula: C19H17N5O3S MolecularWeight: 395.43498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C(C=C1)C#N)SCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=NC(=C(C=C1)C#N)SCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O3S/c1-12(2)9-15-6-3-14(10-20)19(21-15)28-11-17-22-23-18(27-17)13-4-7-16(8-5-13)24(25)26/h3-8,12H,9,11H2,1-2H3