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

Systemtic Name: 2-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-prop-2-ynyl-guanidine Openeye Name: 2-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-prop-2-ynyl-guanidine CAS Name: 2-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-1-prop-2-ynylguanidine IUPAC Name: 2-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-1-prop-2-ynylguanidine Traditional Name: 2-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-1-propargyl-guanidine Formula: C12H16N6S MolecularWeight: 276.36064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCN(CC#C)C(=NC#N)N

Isomeric SMILES

CC1=C(N=CN1)CSCCN(CC#C)C(=NC#N)N

InChI

InChI=1S/C12H16N6S/c1-3-4-18(12(14)15-8-13)5-6-19-7-11-10(2)16-9-17-11/h1,9H,4-7H2,2H3,(H2,14,15)(H,16,17)