3-(phenylmethyl)-4-pyrrol-1-yl-1,2,4-triazole

Systemtic Name: 3-(phenylmethyl)-4-pyrrol-1-yl-1,2,4-triazole Openeye Name: 3-benzyl-4-pyrrol-1-yl-1,2,4-triazole CAS Name: 3-(phenylmethyl)-4-(1-pyrrolyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-pyrrol-1-yl-1,2,4-triazole Traditional Name: 3-benzyl-4-pyrrol-1-yl-1,2,4-triazole Formula: C13H12N4 MolecularWeight: 224.26118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=CN2N3C=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=CN2N3C=CC=C3

InChI

InChI=1S/C13H12N4/c1-2-6-12(7-3-1)10-13-15-14-11-17(13)16-8-4-5-9-16/h1-9,11H,10H2