4-[5-[1-(3-nitrophenyl)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[1-(3-nitrophenyl)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-allyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[1-(3-nitrophenyl)ethylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[1-(3-nitrophenyl)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-allyl-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazol-3-yl]pyridine Formula: C18H17N5O2S MolecularWeight: 367.42488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(N2CC=C)C3=CC=NC=C3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(N2CC=C)C3=CC=NC=C3

InChI

InChI=1S/C18H17N5O2S/c1-3-11-22-17(14-7-9-19-10-8-14)20-21-18(22)26-13(2)15-5-4-6-16(12-15)23(24)25/h3-10,12-13H,1,11H2,2H3