4-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]ethoxy]benzonitrile Formula: C17H20N4OS MolecularWeight: 328.4319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H20N4OS/c1-12(2)16-19-20-17(21(16)14-5-6-14)23-10-9-22-15-7-3-13(11-18)4-8-15/h3-4,7-8,12,14H,5-6,9-10H2,1-2H3