(E)-3-(methylamino)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]prop-2-enenitrile

Systemtic Name: (E)-3-(methylamino)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]prop-2-enenitrile Openeye Name: (E)-3-(methylamino)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]prop-2-enenitrile CAS Name: (E)-3-(methylamino)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-2-propenenitrile IUPAC Name: (E)-3-(methylamino)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]prop-2-enenitrile Traditional Name: (E)-3-(methylamino)-3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]acrylonitrile Formula: C11H17N5S MolecularWeight: 251.35118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17N5S/c1-9-10(16-8-15-9)7-17-6-5-14-11(13-2)3-4-12/h3,8,13-14H,5-7H2,1-2H3,(H,15,16)/b11-3+