1H-imidazole; 1-methyl-4-(phenylmethylsulfanyl)imidazole

Systemtic Name: 1H-imidazole; 1-methyl-4-(phenylmethylsulfanyl)imidazole Openeye Name: 4-benzylsulfanyl-1-methyl-imidazole; imidazole CAS Name: 1H-imidazole; 1-methyl-4-(phenylmethylthio)imidazole IUPAC Name: 4-benzylsulfanyl-1-methylimidazole; 1H-imidazole Traditional Name: 4-(benzylthio)-1-methyl-imidazole; glyoxaline Formula: C14H16N4S MolecularWeight: 272.36864

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)SCC2=CC=CC=C2.C1=CN=CN1

Isomeric SMILES

CN1C=C(N=C1)SCC2=CC=CC=C2.C1=CN=CN1

InChI

InChI=1S/C11H12N2S.C3H4N2/c1-13-7-11(12-9-13)14-8-10-5-3-2-4-6-10;1-2-5-3-4-1/h2-7,9H,8H2,1H3;1-3H,(H,4,5)