2-[[2-(2-azidoethyl)-5-phenylsulfanyl-4-propan-2-yl-imidazol-1-yl]methyl]pyridine

Systemtic Name: 2-[[2-(2-azidoethyl)-5-phenylsulfanyl-4-propan-2-yl-imidazol-1-yl]methyl]pyridine Openeye Name: 2-[[2-(2-azidoethyl)-4-isopropyl-5-phenylsulfanyl-imidazol-1-yl]methyl]pyridine CAS Name: 2-[[2-(2-azidoethyl)-5-(phenylthio)-4-propan-2-yl-1-imidazolyl]methyl]pyridine IUPAC Name: 2-[[2-(2-azidoethyl)-5-phenylsulfanyl-4-propan-2-ylimidazol-1-yl]methyl]pyridine Traditional Name: 2-[[2-(2-azidoethyl)-4-isopropyl-5-(phenylthio)imidazol-1-yl]methyl]pyridine Formula: C20H22N6S MolecularWeight: 378.49388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCN=[N+]=[N-])CC2=CC=CC=N2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCN=[N+]=[N-])CC2=CC=CC=N2)SC3=CC=CC=C3

InChI

InChI=1S/C20H22N6S/c1-15(2)19-20(27-17-9-4-3-5-10-17)26(14-16-8-6-7-12-22-16)18(24-19)11-13-23-25-21/h3-10,12,15H,11,13-14H2,1-2H3