3-methyl-5-(phenylmethylsulfanyl)-4-pyrrol-1-yl-1,2,4-triazole

Systemtic Name: 3-methyl-5-(phenylmethylsulfanyl)-4-pyrrol-1-yl-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-methyl-4-pyrrol-1-yl-1,2,4-triazole CAS Name: 3-methyl-5-(phenylmethylthio)-4-(1-pyrrolyl)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-methyl-4-pyrrol-1-yl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-methyl-4-pyrrol-1-yl-1,2,4-triazole Formula: C14H14N4S MolecularWeight: 270.35276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N2C=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1N2C=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C14H14N4S/c1-12-15-16-14(18(12)17-9-5-6-10-17)19-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3