2-[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyrazine

Systemtic Name: 2-[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrazine CAS Name: 2-[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrazine Traditional Name: 2-[4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]pyrazine Formula: C14H13N5S MolecularWeight: 283.35152

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CC=C2)C3=NC=CN=C3

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CC=C2)C3=NC=CN=C3

InChI

InChI=1S/C14H13N5S/c1-20-14-18-17-13(12-9-15-7-8-16-12)19(14)10-11-5-3-2-4-6-11/h2-9H,10H2,1H3