2-cyano-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-N'-prop-2-ynyl-ethanimidamide

Systemtic Name: 2-cyano-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-N'-prop-2-ynyl-ethanimidamide Openeye Name: 2-cyano-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-N'-prop-2-ynyl-acetamidine CAS Name: 2-cyano-N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-N'-prop-2-ynylethanimidamide IUPAC Name: 2-cyano-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-N'-prop-2-ynylethanimidamide Traditional Name: 2-cyano-N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-N'-propargyl-acetamidine Formula: C13H17N5S MolecularWeight: 275.37258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC(=NCC#C)CC#N

Isomeric SMILES

CC1=C(N=CN1)CSCCNC(=NCC#C)CC#N

InChI

InChI=1S/C13H17N5S/c1-3-6-15-13(4-5-14)16-7-8-19-9-12-11(2)17-10-18-12/h1,10H,4,6-9H2,2H3,(H,15,16)(H,17,18)