4-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]butanenitrile

Systemtic Name: 4-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]butanenitrile Openeye Name: 4-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]butanenitrile CAS Name: 4-[(5-methyl-1H-imidazol-4-yl)methylthio]butanenitrile IUPAC Name: 4-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]butanenitrile Traditional Name: 4-[(5-methyl-1H-imidazol-4-yl)methylthio]butyronitrile Formula: C9H13N3S MolecularWeight: 195.28462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCCC#N

Isomeric SMILES

CC1=C(N=CN1)CSCCCC#N

InChI

InChI=1S/C9H13N3S/c1-8-9(12-7-11-8)6-13-5-3-2-4-10/h7H,2-3,5-6H2,1H3,(H,11,12)