4-(phenylmethylsulfanyl)-1H-imidazole-5-carbothioamide

Systemtic Name: 4-(phenylmethylsulfanyl)-1H-imidazole-5-carbothioamide Openeye Name: 4-benzylsulfanyl-1H-imidazole-5-carbothioamide CAS Name: 4-(phenylmethylthio)-1H-imidazole-5-carbothioamide IUPAC Name: 4-benzylsulfanyl-1H-imidazole-5-carbothioamide Traditional Name: 4-(benzylthio)-1H-imidazole-5-carbothioamide Formula: C11H11N3S2 MolecularWeight: 249.35514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(NC=N2)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(NC=N2)C(=S)N

InChI

InChI=1S/C11H11N3S2/c12-10(15)9-11(14-7-13-9)16-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,12,15)(H,13,14)