2-[5-[(4-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine

Systemtic Name: 2-[5-[(4-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-[4-allyl-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyrazine CAS Name: 2-[5-[(4-methoxyphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-[5-[(4-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine Traditional Name: 2-[4-allyl-5-(p-anisylthio)-1,2,4-triazol-3-yl]pyrazine Formula: C17H17N5OS MolecularWeight: 339.41478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=NC=CN=C3

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=NC=CN=C3

InChI

InChI=1S/C17H17N5OS/c1-3-10-22-16(15-11-18-8-9-19-15)20-21-17(22)24-12-13-4-6-14(23-2)7-5-13/h3-9,11H,1,10,12H2,2H3