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

Systemtic Name: 2-[5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-[4-allyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyrazine CAS Name: 2-[5-[(3-methoxyphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-[5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyrazine Traditional Name: 2-[4-allyl-5-(m-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=CC(=C1)CSC2=NN=C(N2CC=C)C3=NC=CN=C3

Isomeric SMILES

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

InChI

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