2-[[5-(2-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-quinoxaline

Systemtic Name: 2-[[5-(2-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-quinoxaline Openeye Name: 2-[[4-allyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-quinoxaline CAS Name: 2-[[[5-(2-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]methyl]-3-methylquinoxaline IUPAC Name: 2-[[5-(2-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methylquinoxaline Traditional Name: 2-[[[4-allyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-3-methyl-quinoxaline Formula: C21H18FN5S MolecularWeight: 391.464523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(N3CC=C)C4=CC=CC=C4F

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(N3CC=C)C4=CC=CC=C4F

InChI

InChI=1S/C21H18FN5S/c1-3-12-27-20(15-8-4-5-9-16(15)22)25-26-21(27)28-13-19-14(2)23-17-10-6-7-11-18(17)24-19/h3-11H,1,12-13H2,2H3